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You searched for +publisher:"University of North Texas" +contributor:("Wilson, Angela K."). Showing records 1 – 30 of 47 total matches.

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University of North Texas

1. Kerr, Katherine Elaine. Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species.

Degree: 2014, University of North Texas

 The reactions of atomic hydrogen with methanethiol and that of atomic hydrogen with carbon disulfide were studied experimentally using flash-photolysis resonance-fluorescence techniques. Rate constants were… (more)

Subjects/Keywords: Kinetics; carbon disulfide; methanethiol; Atomic hydrogen.; Carbon disulfide.; Sulfur.; Flash photolysis.

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APA (6th Edition):

Kerr, K. E. (2014). Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc699887/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Kerr, Katherine Elaine. “Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species.” 2014. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc699887/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Kerr, Katherine Elaine. “Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species.” 2014. Web. 17 Oct 2019.

Vancouver:

Kerr KE. Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species. [Internet] [Thesis]. University of North Texas; 2014. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc699887/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Kerr KE. Kinetic Investigation of Atomic Hydrogen with Sulfur-Containing Species. [Thesis]. University of North Texas; 2014. Available from: https://digital.library.unt.edu/ark:/67531/metadc699887/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

2. Wang, Jiaqi. Transition Metal Catalyzed Oxidative Cleavage of C-O Bond.

Degree: 2015, University of North Texas

 The focus of this thesis is on C-O bonds activation by transition metal atoms. Lignin is a potential alternative energy resource, but currently is an… (more)

Subjects/Keywords: bond activation; density functional theory (DFT); transition metal; Transition metals.; Chemical bonds.; Density functionals.

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APA (6th Edition):

Wang, J. (2015). Transition Metal Catalyzed Oxidative Cleavage of C-O Bond. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc801914/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Wang, Jiaqi. “Transition Metal Catalyzed Oxidative Cleavage of C-O Bond.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc801914/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Wang, Jiaqi. “Transition Metal Catalyzed Oxidative Cleavage of C-O Bond.” 2015. Web. 17 Oct 2019.

Vancouver:

Wang J. Transition Metal Catalyzed Oxidative Cleavage of C-O Bond. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc801914/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Wang J. Transition Metal Catalyzed Oxidative Cleavage of C-O Bond. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc801914/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

3. Oyedepo, Gbenga A. The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties.

Degree: 2011, University of North Texas

 The multi-reference correlation consistent composite approach (MR-ccCA) was designed to reproduce the accuracy of more computationally intensive ab initio quantum mechanical methods like MR-ACPF-DK/aug-cc-pCV?Z-DK, albeit… (more)

Subjects/Keywords: ccCA; rp-ccCA; MR-ccCa; composite methods; multi-reference methods; CCSD(T)/CBS

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APA (6th Edition):

Oyedepo, G. A. (2011). The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc103368/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Oyedepo, Gbenga A. “The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties.” 2011. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc103368/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Oyedepo, Gbenga A. “The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties.” 2011. Web. 17 Oct 2019.

Vancouver:

Oyedepo GA. The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties. [Internet] [Thesis]. University of North Texas; 2011. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc103368/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Oyedepo GA. The Multi-reference Correlation Consistent Composite Approach: A New Vista In Quantitative Prediction Of Thermochemical And Spectroscopic Properties. [Thesis]. University of North Texas; 2011. Available from: https://digital.library.unt.edu/ark:/67531/metadc103368/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

4. South, Christopher James. Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules.

Degree: 2016, University of North Texas

 Quantum chemical methods have been used to model a variety of p- and f-block chemical species to gain insight about their energetic and spectroscopic properties.… (more)

Subjects/Keywords: Computational; Lanthanide; Actinide; MR-ccCA; Ab initio; Relativistic; DFT

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APA (6th Edition):

South, C. J. (2016). Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc862830/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

South, Christopher James. “Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules.” 2016. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc862830/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

South, Christopher James. “Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules.” 2016. Web. 17 Oct 2019.

Vancouver:

South CJ. Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules. [Internet] [Thesis]. University of North Texas; 2016. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc862830/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

South CJ. Quantum Chemistry Calculations of Energetic and Spectroscopic Properties of p- and f-Block Molecules. [Thesis]. University of North Texas; 2016. Available from: https://digital.library.unt.edu/ark:/67531/metadc862830/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

5. Gibson, Joshua S. From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets.

Degree: 2014, University of North Texas

 The development of the semi-empirical atomistic potential called the embedded atom method (EAM) has allowed for the efficient modeling of solid-state environments, at a lower… (more)

Subjects/Keywords: Correlation consistent basis sets; modified embedded atom method; density functional theory

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APA (6th Edition):

Gibson, J. S. (2014). From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc500219/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Gibson, Joshua S. “From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets.” 2014. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc500219/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Gibson, Joshua S. “From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets.” 2014. Web. 17 Oct 2019.

Vancouver:

Gibson JS. From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets. [Internet] [Thesis]. University of North Texas; 2014. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc500219/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Gibson JS. From Development of Semi-empirical Atomistic Potentials to Applications of Correlation Consistent Basis Sets. [Thesis]. University of North Texas; 2014. Available from: https://digital.library.unt.edu/ark:/67531/metadc500219/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

6. Williams, T. Gavin. Examination and Development of the Correlation Consistent Composite Approach.

Degree: 2010, University of North Texas

 The primary focus of this dissertation is the advancement of the correlation consistent composite approach (ccCA) methodology from its original formulation to the current implementation.… (more)

Subjects/Keywords: Chemestry; ab initio; modeling; Chemistry  – Mathematics.; Linear free energy relationship.

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APA (6th Edition):

Williams, T. G. (2010). Examination and Development of the Correlation Consistent Composite Approach. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc33213/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Williams, T Gavin. “Examination and Development of the Correlation Consistent Composite Approach.” 2010. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc33213/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Williams, T Gavin. “Examination and Development of the Correlation Consistent Composite Approach.” 2010. Web. 17 Oct 2019.

Vancouver:

Williams TG. Examination and Development of the Correlation Consistent Composite Approach. [Internet] [Thesis]. University of North Texas; 2010. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc33213/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Williams TG. Examination and Development of the Correlation Consistent Composite Approach. [Thesis]. University of North Texas; 2010. Available from: https://digital.library.unt.edu/ark:/67531/metadc33213/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

7. Laury, Marie L. Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods.

Degree: 2013, University of North Texas

 Computational chemistry has led to the greater understanding of the molecular world, from the interaction of molecules, to the composition of molecular species and materials.… (more)

Subjects/Keywords: Ab initio; density functional theory; transition metal; computational chemistry

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APA (6th Edition):

Laury, M. L. (2013). Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc500071/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Laury, Marie L. “Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods.” 2013. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc500071/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Laury, Marie L. “Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods.” 2013. Web. 17 Oct 2019.

Vancouver:

Laury ML. Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods. [Internet] [Thesis]. University of North Texas; 2013. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc500071/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Laury ML. Accurate and Reliable Prediction of Energetic and Spectroscopic Properties Via Electronic Structure Methods. [Thesis]. University of North Texas; 2013. Available from: https://digital.library.unt.edu/ark:/67531/metadc500071/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

8. Jeffrey, Chris C. Applications of Single Reference Methods to Multi-Reference Problems.

Degree: 2015, University of North Texas

 Density functional theory is an efficient and useful method of solving single-reference computational chemistry problems, however it struggles with multi-reference systems. Modifications have been developed… (more)

Subjects/Keywords: density function theory; multi-reference lanthanide; lanthanide trifluoride; non-dynamical correlation; Density functionals.; Mathematical optimization.; Rare earth metals.; Quantum chemistry.

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APA (6th Edition):

Jeffrey, C. C. (2015). Applications of Single Reference Methods to Multi-Reference Problems. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc801919/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Jeffrey, Chris C. “Applications of Single Reference Methods to Multi-Reference Problems.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc801919/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Jeffrey, Chris C. “Applications of Single Reference Methods to Multi-Reference Problems.” 2015. Web. 17 Oct 2019.

Vancouver:

Jeffrey CC. Applications of Single Reference Methods to Multi-Reference Problems. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc801919/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Jeffrey CC. Applications of Single Reference Methods to Multi-Reference Problems. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc801919/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

9. Wang, Jiaqi. The Impact of Computational Methods on Transition Metal-containing Species.

Degree: 2015, University of North Texas

 Quantum chemistry methodologies can be used to address a wide variety of chemical problems. Key to the success of quantum chemistry methodologies, however, is the… (more)

Subjects/Keywords: transition metal; density functional theory; multi reference character; Quantum chemistry.; Transition metals.; Chemistry  – Mathematics.; Density functionals.

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APA (6th Edition):

Wang, J. (2015). The Impact of Computational Methods on Transition Metal-containing Species. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc822795/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Wang, Jiaqi. “The Impact of Computational Methods on Transition Metal-containing Species.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc822795/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Wang, Jiaqi. “The Impact of Computational Methods on Transition Metal-containing Species.” 2015. Web. 17 Oct 2019.

Vancouver:

Wang J. The Impact of Computational Methods on Transition Metal-containing Species. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc822795/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Wang J. The Impact of Computational Methods on Transition Metal-containing Species. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc822795/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

10. Liu, Cong. Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation.

Degree: 2013, University of North Texas

 CO2 activation and conversion mediated by transition metal (TM) catalysts were investigated. Homogeneous catalysis of the reverse water gas shift reaction CO2+H2→H2O+CO was studied as… (more)

Subjects/Keywords: Transition metal; catalysis; lignin; dimethyl ether; CO2; computational study; DFT

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APA (6th Edition):

Liu, C. (2013). Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc283790/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Liu, Cong. “Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation.” 2013. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc283790/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Liu, Cong. “Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation.” 2013. Web. 17 Oct 2019.

Vancouver:

Liu C. Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation. [Internet] [Thesis]. University of North Texas; 2013. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc283790/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Liu C. Transition Metal Mediated C-o Bond Cleavage: From Co2 Activation to Lignin Degradation. [Thesis]. University of North Texas; 2013. Available from: https://digital.library.unt.edu/ark:/67531/metadc283790/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

11. Borders, Tammie L. Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach.

Degree: 2012, University of North Texas

 Carbon nanotubes (CNT) have unparalleled mechanical properties, spanning several orders of magnitude over both length and time scales. Computational and experimental results vary greatly, partly… (more)

Subjects/Keywords: Informatics; molecular dynamics; nanotechnology; mechanical properties

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APA (6th Edition):

Borders, T. L. (2012). Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc115050/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Borders, Tammie L. “Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach.” 2012. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc115050/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Borders, Tammie L. “Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach.” 2012. Web. 17 Oct 2019.

Vancouver:

Borders TL. Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach. [Internet] [Thesis]. University of North Texas; 2012. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc115050/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Borders TL. Knowledge Discovery of Nanotube Mechanical Properties With an Informatics-Molecular Dynamics Approach. [Thesis]. University of North Texas; 2012. Available from: https://digital.library.unt.edu/ark:/67531/metadc115050/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

12. Determan, John J. Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation.

Degree: 2011, University of North Texas

 Copper(I) complexes have been studied through both experimental and computational means in the presented work. Overall, the work focuses on photophysical and photochemical properties of… (more)

Subjects/Keywords: Copper(I) complexes; OLED; luminescence; photochemistry; photophysics

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APA (6th Edition):

Determan, J. J. (2011). Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc84199/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Determan, John J. “Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation.” 2011. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc84199/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Determan, John J. “Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation.” 2011. Web. 17 Oct 2019.

Vancouver:

Determan JJ. Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation. [Internet] [Thesis]. University of North Texas; 2011. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc84199/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Determan JJ. Photophysics and Photochemistry of Copper(I) Phosphine and Collidine Complexes: An Experimental/Theoretical Investigation. [Thesis]. University of North Texas; 2011. Available from: https://digital.library.unt.edu/ark:/67531/metadc84199/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

13. Tekarli, Sammer M. Computational Investigation of Molecular Optoelectronic and Biological Systems.

Degree: 2011, University of North Texas

 The scope of work in this dissertation has comprised several major investigations on applications and theoretical studies of ab initio quantum mechanics and density functional… (more)

Subjects/Keywords: computational; optoelctronic; ccCA,; quantum mechanics; consistent composite approach

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APA (6th Edition):

Tekarli, S. M. (2011). Computational Investigation of Molecular Optoelectronic and Biological Systems. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc84288/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Tekarli, Sammer M. “Computational Investigation of Molecular Optoelectronic and Biological Systems.” 2011. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc84288/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Tekarli, Sammer M. “Computational Investigation of Molecular Optoelectronic and Biological Systems.” 2011. Web. 17 Oct 2019.

Vancouver:

Tekarli SM. Computational Investigation of Molecular Optoelectronic and Biological Systems. [Internet] [Thesis]. University of North Texas; 2011. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc84288/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Tekarli SM. Computational Investigation of Molecular Optoelectronic and Biological Systems. [Thesis]. University of North Texas; 2011. Available from: https://digital.library.unt.edu/ark:/67531/metadc84288/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

14. Wilson, Brent R. Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach.

Degree: 2011, University of North Texas

 One of the central concerns of computational chemistry is that of efficiency (i.e. the development of methodologies which will yield increased accuracy of prediction without… (more)

Subjects/Keywords: quantum chemistry; hydrocarbons; composite methods

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APA (6th Edition):

Wilson, B. R. (2011). Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc84300/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Wilson, Brent R. “Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach.” 2011. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc84300/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Wilson, Brent R. “Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach.” 2011. Web. 17 Oct 2019.

Vancouver:

Wilson BR. Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach. [Internet] [Thesis]. University of North Texas; 2011. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc84300/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Wilson BR. Accuracy and Efficiency in Computational Chemistry: The Correlation Consistent Composite Approach. [Thesis]. University of North Texas; 2011. Available from: https://digital.library.unt.edu/ark:/67531/metadc84300/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

15. Mahler, Andrew. The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations.

Degree: 2016, University of North Texas

 In the exploration of chemical systems through quantum mechanics, accurate treatment of the electron wavefunction, and the related electron density, is fundamental to extracting information… (more)

Subjects/Keywords: Physical Chemistry; Theoretical Chemistry; Basis Sets; Wavefunction; Explicitly Correlated; Density Functional Theory; Chemistry, Physical

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APA (6th Edition):

Mahler, A. (2016). The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc849642/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Mahler, Andrew. “The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations.” 2016. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc849642/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Mahler, Andrew. “The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations.” 2016. Web. 17 Oct 2019.

Vancouver:

Mahler A. The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations. [Internet] [Thesis]. University of North Texas; 2016. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc849642/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Mahler A. The One Electron Basis Set: Challenges in Wavefunction and Electron Density Calculations. [Thesis]. University of North Texas; 2016. Available from: https://digital.library.unt.edu/ark:/67531/metadc849642/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

16. Arvapally, Ravi K. Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects.

Degree: 2010, University of North Texas

 The major topics discussed are the phosphorescence sensitization in the lanthanides via energy transfer and in the organics by heavy atom effects. The f-f transitions… (more)

Subjects/Keywords: Lanthanides; Phosphorescence.; sensitization; aromatics; Rare earth metals.; Energy transfer.; Luminescence.; Aromatic compounds.

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APA (6th Edition):

Arvapally, R. K. (2010). Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc28388/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Arvapally, Ravi K. “Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects.” 2010. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc28388/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Arvapally, Ravi K. “Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects.” 2010. Web. 17 Oct 2019.

Vancouver:

Arvapally RK. Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects. [Internet] [Thesis]. University of North Texas; 2010. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc28388/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Arvapally RK. Sensitization of Lanthanides and Organic-Based Phosphorescence via Energy Transfer and Heavy-Atom Effects. [Thesis]. University of North Texas; 2010. Available from: https://digital.library.unt.edu/ark:/67531/metadc28388/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

17. Pierpont, Aaron. Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes.

Degree: 2010, University of North Texas

 Methane and dinitrogen are abundant precursors to numerous valuable chemicals such as methanol and ammonia, respectively. However, given the robustness of these substrates, catalytically circumventing… (more)

Subjects/Keywords: C-H activation; computational inorganic catalysis; methane functionization; N2 activation; Transition metal complexes.; Methane.; Nitrogen.

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APA (6th Edition):

Pierpont, A. (2010). Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc28462/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Pierpont, Aaron. “Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes.” 2010. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc28462/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Pierpont, Aaron. “Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes.” 2010. Web. 17 Oct 2019.

Vancouver:

Pierpont A. Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes. [Internet] [Thesis]. University of North Texas; 2010. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc28462/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Pierpont A. Computational Study of Small Molecule Activation via Low-Coordinate Late First-Row Transition Metal Complexes. [Thesis]. University of North Texas; 2010. Available from: https://digital.library.unt.edu/ark:/67531/metadc28462/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

18. Fogueri, Uma. Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation.

Degree: 2013, University of North Texas

 In this work we address two problems in computational chemistry relevant to biomolecular modeling. In the first project, we consider the conformer space of melatonin… (more)

Subjects/Keywords: Melatonin conformers; DFT based diagnostic; nondynamical correlation

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APA (6th Edition):

Fogueri, U. (2013). Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc500195/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Fogueri, Uma. “Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation.” 2013. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc500195/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Fogueri, Uma. “Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation.” 2013. Web. 17 Oct 2019.

Vancouver:

Fogueri U. Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation. [Internet] [Thesis]. University of North Texas; 2013. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc500195/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Fogueri U. Ab Initio and Density Functional Investigation of the Conformer Manifold of Melatonin and a Proposal for a Simple Dft-based Diagnostic for Nondynamical Correlation. [Thesis]. University of North Texas; 2013. Available from: https://digital.library.unt.edu/ark:/67531/metadc500195/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

19. Riojas, Amanda G. Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions.

Degree: 2015, University of North Texas

 Advances in computing capabilities have facilitated the application of quantum mechanical methods to increasingly larger and more complex chemical systems, including weakly interacting and biologically… (more)

Subjects/Keywords: composite methods; correlation consistent composite approach (ccCA); Solv-ccCA method; noncovalent interactions; Chemistry  – Mathematics.; Chemistry  – Computer simulation.; Biological systems  – Mathematical models.; Heat of formation.; Organophosphorus compounds.; Chemical bonds.

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APA (6th Edition):

Riojas, A. G. (2015). Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc801886/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Riojas, Amanda G. “Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc801886/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Riojas, Amanda G. “Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions.” 2015. Web. 17 Oct 2019.

Vancouver:

Riojas AG. Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc801886/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Riojas AG. Application of the Correlation Consistent Composite Approach to Biological Systems and Noncovalent Interactions. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc801886/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

20. Peterson, Charles Campbell. Accurate Energetics Across the Periodic Table Via Quantum Chemistry.

Degree: 2015, University of North Texas

 Greater understanding and accurate predictions of structural, thermochemical, and spectroscopic properties of chemical compounds is critical for the advancements of not only basic science, but… (more)

Subjects/Keywords: computational quantum composite; chemical compounds; heavy element systems; Rare earth metal compounds.; Transition metals.; Quantum chemistry.

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APA (6th Edition):

Peterson, C. C. (2015). Accurate Energetics Across the Periodic Table Via Quantum Chemistry. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc822822/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Peterson, Charles Campbell. “Accurate Energetics Across the Periodic Table Via Quantum Chemistry.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc822822/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Peterson, Charles Campbell. “Accurate Energetics Across the Periodic Table Via Quantum Chemistry.” 2015. Web. 17 Oct 2019.

Vancouver:

Peterson CC. Accurate Energetics Across the Periodic Table Via Quantum Chemistry. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc822822/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Peterson CC. Accurate Energetics Across the Periodic Table Via Quantum Chemistry. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc822822/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

21. Weber, Rebecca J. Computational Modeling of Small Molecules.

Degree: 2015, University of North Texas

 Computational chemistry lies at the intersection of chemistry, physics, mathematics, and computer science, and can be used to explain the behavior of atoms and molecules,… (more)

Subjects/Keywords: Ab intio; DFT; lanthanides; basis sets; CBS; extrapolation; CCCA; CCSD (T); Molecular dynamics.; Molecular structure.; Chemistry  – Mathematics.

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APA (6th Edition):

Weber, R. J. (2015). Computational Modeling of Small Molecules. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc822766/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Weber, Rebecca J. “Computational Modeling of Small Molecules.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc822766/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Weber, Rebecca J. “Computational Modeling of Small Molecules.” 2015. Web. 17 Oct 2019.

Vancouver:

Weber RJ. Computational Modeling of Small Molecules. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc822766/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Weber RJ. Computational Modeling of Small Molecules. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc822766/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

22. Jorgensen, Kameron R. Thermochemistry Investigations Via the Correlation Consistent Composite Approach.

Degree: 2012, University of North Texas

 Since the development of the correlation consistent composite approach (ccCA) in 2006, ccCA has been shown to be applicable across the periodic table, producing, on… (more)

Subjects/Keywords: Correlation consistent composite approach; thermodynamics; computational chemistry

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APA (6th Edition):

Jorgensen, K. R. (2012). Thermochemistry Investigations Via the Correlation Consistent Composite Approach. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc177216/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Jorgensen, Kameron R. “Thermochemistry Investigations Via the Correlation Consistent Composite Approach.” 2012. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc177216/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Jorgensen, Kameron R. “Thermochemistry Investigations Via the Correlation Consistent Composite Approach.” 2012. Web. 17 Oct 2019.

Vancouver:

Jorgensen KR. Thermochemistry Investigations Via the Correlation Consistent Composite Approach. [Internet] [Thesis]. University of North Texas; 2012. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc177216/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Jorgensen KR. Thermochemistry Investigations Via the Correlation Consistent Composite Approach. [Thesis]. University of North Texas; 2012. Available from: https://digital.library.unt.edu/ark:/67531/metadc177216/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

23. Figg, Travis M. Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization.

Degree: 2013, University of North Texas

 There is a high demand for the development of processes for the conversion of ubiquitous molecules into industrially useful commodities. Transition metal catalysts are often… (more)

Subjects/Keywords: Chemistry; organometallic; catalyst; computational

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APA (6th Edition):

Figg, T. M. (2013). Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc271814/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Figg, Travis M. “Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization.” 2013. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc271814/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Figg, Travis M. “Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization.” 2013. Web. 17 Oct 2019.

Vancouver:

Figg TM. Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization. [Internet] [Thesis]. University of North Texas; 2013. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc271814/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Figg TM. Modeling Transition Metal Catalysts for Small Molecule Activation and Functionalization. [Thesis]. University of North Texas; 2013. Available from: https://digital.library.unt.edu/ark:/67531/metadc271814/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

24. Olatunji-Ojo, Olayinka A. Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale.

Degree: 2013, University of North Texas

 Multiscale modeling is an effective tool for integrating different computational methods, creating a way of modeling diverse chemical and physical phenomena. Presented are studies on… (more)

Subjects/Keywords: Inorganic systems; multiscale modeling; atomistic; continuum; scale; computational

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APA (6th Edition):

Olatunji-Ojo, O. A. (2013). Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc283802/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Olatunji-Ojo, Olayinka A. “Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale.” 2013. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc283802/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Olatunji-Ojo, Olayinka A. “Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale.” 2013. Web. 17 Oct 2019.

Vancouver:

Olatunji-Ojo OA. Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale. [Internet] [Thesis]. University of North Texas; 2013. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc283802/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Olatunji-Ojo OA. Computational Studies of Inorganic Systems with a Multiscale Modeling Approach: From Atomistic to Continuum Scale. [Thesis]. University of North Texas; 2013. Available from: https://digital.library.unt.edu/ark:/67531/metadc283802/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

25. Morello, Glenn. Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules.

Degree: 2011, University of North Texas

 The diversity of transition metal complexes allows for a wide range of chemical processes to be mediated by the metal, from catalysis to surface chemistry.… (more)

Subjects/Keywords: DFT; Baeyer-Villiger; hydroarylation; nitrene; transition metals

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APA (6th Edition):

Morello, G. (2011). Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc84255/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Morello, Glenn. “Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules.” 2011. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc84255/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Morello, Glenn. “Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules.” 2011. Web. 17 Oct 2019.

Vancouver:

Morello G. Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules. [Internet] [Thesis]. University of North Texas; 2011. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc84255/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Morello G. Modeling Transition Metal Chemistry for Catalytic Functionalization of Molecules. [Thesis]. University of North Texas; 2011. Available from: https://digital.library.unt.edu/ark:/67531/metadc84255/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

26. Pardue, Daniel B. Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes.

Degree: 2015, University of North Texas

 Density Functional Theory (DFT) is an effective tool for studying diverse metal systems. Presented herein are studies of a variety of metal systems, which can… (more)

Subjects/Keywords: Density Ffunctional Theory (DFT); alkali metal amides; diverse metal systems; Transition metal complexes.; Density functionals.; Chemical bonds.

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APA (6th Edition):

Pardue, D. B. (2015). Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc801892/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Pardue, Daniel B. “Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes.” 2015. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc801892/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Pardue, Daniel B. “Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes.” 2015. Web. 17 Oct 2019.

Vancouver:

Pardue DB. Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes. [Internet] [Thesis]. University of North Texas; 2015. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc801892/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Pardue DB. Computational Studies of C–H/C–C Manipulation Utilizing Transition Metal Complexes. [Thesis]. University of North Texas; 2015. Available from: https://digital.library.unt.edu/ark:/67531/metadc801892/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

27. Sinha, Pankaj. A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems.

Degree: 2007, University of North Texas

 Calculations were performed on transition-metal complexes to (1) extrapolate the structure and bonding of the ground and phosphorescent states (2) determine the luminescence energies and… (more)

Subjects/Keywords: Photophysical; Van der Waals; luminescence; Van der Waals forces.; Transition metal complexes.; Phosphorescence.; Luminescence.

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APA (6th Edition):

Sinha, P. (2007). A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc5121/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Sinha, Pankaj. “A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems.” 2007. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc5121/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Sinha, Pankaj. “A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems.” 2007. Web. 17 Oct 2019.

Vancouver:

Sinha P. A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems. [Internet] [Thesis]. University of North Texas; 2007. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc5121/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Sinha P. A Computational Investigation of the Photophysical, Electronic and Bonding Properties of Exciplex-Forming Van der Waals Systems. [Thesis]. University of North Texas; 2007. Available from: https://digital.library.unt.edu/ark:/67531/metadc5121/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

28. Determan, John J. Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers.

Degree: 2008, University of North Texas

 Density functional (ca, BLYP, BPW91, B3LYP and B3PW91), MP2 and CCSD(T) methods in combination with LANL2DZ or cc-pVxZ-PP (where x=D(double), T(triple) Q(quadruple), and 5(quintuple)) basis… (more)

Subjects/Keywords: Oligomers.; extended excimers; computational studies; bonding properties; phosphorescent properties; Chemical bonds.; Phosphorescence.

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APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Determan, J. J. (2008). Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc9108/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Determan, John J. “Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers.” 2008. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc9108/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Determan, John J. “Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers.” 2008. Web. 17 Oct 2019.

Vancouver:

Determan JJ. Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers. [Internet] [Thesis]. University of North Texas; 2008. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc9108/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Determan JJ. Computational Studies of Bonding and Phosphorescent Properties of Group 12 Oligomers and Extended Excimers. [Thesis]. University of North Texas; 2008. Available from: https://digital.library.unt.edu/ark:/67531/metadc9108/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

29. Naidoo, Jacinth. Investigation of the Pressure Dependence of SO3 Formation.

Degree: 2003, University of North Texas

 The kinetics of the pressure dependent O + SO2 + Ar reaction have been investigated using laser photolysis resonance fluorescence at temperatures of 289 K,… (more)

Subjects/Keywords: Sulfur dioxide.; Flash photolysis.; Pressure dependence; resonance fluorescence and flash photolysis; Lindemann theory; absorption cross-section

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APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Naidoo, J. (2003). Investigation of the Pressure Dependence of SO3 Formation. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc4403/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Naidoo, Jacinth. “Investigation of the Pressure Dependence of SO3 Formation.” 2003. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc4403/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Naidoo, Jacinth. “Investigation of the Pressure Dependence of SO3 Formation.” 2003. Web. 17 Oct 2019.

Vancouver:

Naidoo J. Investigation of the Pressure Dependence of SO3 Formation. [Internet] [Thesis]. University of North Texas; 2003. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc4403/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Naidoo J. Investigation of the Pressure Dependence of SO3 Formation. [Thesis]. University of North Texas; 2003. Available from: https://digital.library.unt.edu/ark:/67531/metadc4403/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation


University of North Texas

30. Dinescu, Adriana. Modeling wild type and mutant glutathione synthetase.

Degree: 2004, University of North Texas

 Glutathione syntethase (GS) is an enzyme that belongs to the ATP-grasp superfamily and catalyzes the second step in the biosynthesis of glutathione. GS has been… (more)

Subjects/Keywords: Glutathione.; Enzymes.; ATP-grasp proteins; molecular dynamics; computational chemistry; GSH; hGS

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APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Dinescu, A. (2004). Modeling wild type and mutant glutathione synthetase. (Thesis). University of North Texas. Retrieved from https://digital.library.unt.edu/ark:/67531/metadc5556/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Dinescu, Adriana. “Modeling wild type and mutant glutathione synthetase.” 2004. Thesis, University of North Texas. Accessed October 17, 2019. https://digital.library.unt.edu/ark:/67531/metadc5556/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Dinescu, Adriana. “Modeling wild type and mutant glutathione synthetase.” 2004. Web. 17 Oct 2019.

Vancouver:

Dinescu A. Modeling wild type and mutant glutathione synthetase. [Internet] [Thesis]. University of North Texas; 2004. [cited 2019 Oct 17]. Available from: https://digital.library.unt.edu/ark:/67531/metadc5556/.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Dinescu A. Modeling wild type and mutant glutathione synthetase. [Thesis]. University of North Texas; 2004. Available from: https://digital.library.unt.edu/ark:/67531/metadc5556/

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

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