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You searched for subject:( Time Dependent Density Functional Theory ). Showing records 1 – 30 of 105749 total matches.

[1] [2] [3] [4] [5] … [3525]

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Tulane University

1. Dougherty, Kelly J. Synthesis of compounds with very large specific rotations.

Degree: 2020, Tulane University

[email protected]

A search in a research database for “large specific rotation” or anything similar produces few articles. Large specific rotation is not commonly used… (more)

Subjects/Keywords: time-dependent density functional theory

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APA (6th Edition):

Dougherty, K. J. (2020). Synthesis of compounds with very large specific rotations. (Thesis). Tulane University. Retrieved from https://digitallibrary.tulane.edu/islandora/object/tulane:120370

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):

Dougherty, Kelly J. “Synthesis of compounds with very large specific rotations.” 2020. Thesis, Tulane University. Accessed September 26, 2020. https://digitallibrary.tulane.edu/islandora/object/tulane:120370.

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

MLA Handbook (7th Edition):

Dougherty, Kelly J. “Synthesis of compounds with very large specific rotations.” 2020. Web. 26 Sep 2020.

Vancouver:

Dougherty KJ. Synthesis of compounds with very large specific rotations. [Internet] [Thesis]. Tulane University; 2020. [cited 2020 Sep 26]. Available from: https://digitallibrary.tulane.edu/islandora/object/tulane:120370.

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

Council of Science Editors:

Dougherty KJ. Synthesis of compounds with very large specific rotations. [Thesis]. Tulane University; 2020. Available from: https://digitallibrary.tulane.edu/islandora/object/tulane:120370

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


Vanderbilt University

2. Kidd, Daniel Wayne. Accelerated Time Propagation in Time-Dependent Density Functional Theory.

Degree: PhD, Physics, 2018, Vanderbilt University

Time-dependent density functional theory (TDDFT) is a widely used, formally exact approach for describing quantum many-body electron dynamics. This approach makes possible the theoretical investigation… (more)

Subjects/Keywords: Density Functional Theory; simulation; basis functions; Time-Dependent Density Functional Theory; exponential integrator; pseudospectral

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APA (6th Edition):

Kidd, D. W. (2018). Accelerated Time Propagation in Time-Dependent Density Functional Theory. (Doctoral Dissertation). Vanderbilt University. Retrieved from http://hdl.handle.net/1803/11656

Chicago Manual of Style (16th Edition):

Kidd, Daniel Wayne. “Accelerated Time Propagation in Time-Dependent Density Functional Theory.” 2018. Doctoral Dissertation, Vanderbilt University. Accessed September 26, 2020. http://hdl.handle.net/1803/11656.

MLA Handbook (7th Edition):

Kidd, Daniel Wayne. “Accelerated Time Propagation in Time-Dependent Density Functional Theory.” 2018. Web. 26 Sep 2020.

Vancouver:

Kidd DW. Accelerated Time Propagation in Time-Dependent Density Functional Theory. [Internet] [Doctoral dissertation]. Vanderbilt University; 2018. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1803/11656.

Council of Science Editors:

Kidd DW. Accelerated Time Propagation in Time-Dependent Density Functional Theory. [Doctoral Dissertation]. Vanderbilt University; 2018. Available from: http://hdl.handle.net/1803/11656


Vanderbilt University

3. Russakoff, Arthur Gerald. The Interaction of Small Molecules and Short Intense Laser Fields.

Degree: PhD, Physics, 2015, Vanderbilt University

 The advent of short intense laser fields promises unprecedented quantum control over chemical reactions. Laser fields of femtosecond duration are now readily available on the… (more)

Subjects/Keywords: molecular dynamics; ehrenfest dynamics; time dependent density functional theory; physics; femtosecond; attosecond; density functional theory

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APA (6th Edition):

Russakoff, A. G. (2015). The Interaction of Small Molecules and Short Intense Laser Fields. (Doctoral Dissertation). Vanderbilt University. Retrieved from http://hdl.handle.net/1803/15339

Chicago Manual of Style (16th Edition):

Russakoff, Arthur Gerald. “The Interaction of Small Molecules and Short Intense Laser Fields.” 2015. Doctoral Dissertation, Vanderbilt University. Accessed September 26, 2020. http://hdl.handle.net/1803/15339.

MLA Handbook (7th Edition):

Russakoff, Arthur Gerald. “The Interaction of Small Molecules and Short Intense Laser Fields.” 2015. Web. 26 Sep 2020.

Vancouver:

Russakoff AG. The Interaction of Small Molecules and Short Intense Laser Fields. [Internet] [Doctoral dissertation]. Vanderbilt University; 2015. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1803/15339.

Council of Science Editors:

Russakoff AG. The Interaction of Small Molecules and Short Intense Laser Fields. [Doctoral Dissertation]. Vanderbilt University; 2015. Available from: http://hdl.handle.net/1803/15339


Brigham Young University

4. Jensen, Daniel S. Real-Space Approach to Time Dependent Current Density Functional Theory.

Degree: MS, 2010, Brigham Young University

  A real-space time-domain calculation of the frequency-dependent dielectric constant of nonmetallic crystals is outlined and the integrals required for this calculation are computed. The… (more)

Subjects/Keywords: Time dependent current density functional theory; density functional theory; molecular integrals; Astrophysics and Astronomy; Physics

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APA (6th Edition):

Jensen, D. S. (2010). Real-Space Approach to Time Dependent Current Density Functional Theory. (Masters Thesis). Brigham Young University. Retrieved from https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=3558&context=etd

Chicago Manual of Style (16th Edition):

Jensen, Daniel S. “Real-Space Approach to Time Dependent Current Density Functional Theory.” 2010. Masters Thesis, Brigham Young University. Accessed September 26, 2020. https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=3558&context=etd.

MLA Handbook (7th Edition):

Jensen, Daniel S. “Real-Space Approach to Time Dependent Current Density Functional Theory.” 2010. Web. 26 Sep 2020.

Vancouver:

Jensen DS. Real-Space Approach to Time Dependent Current Density Functional Theory. [Internet] [Masters thesis]. Brigham Young University; 2010. [cited 2020 Sep 26]. Available from: https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=3558&context=etd.

Council of Science Editors:

Jensen DS. Real-Space Approach to Time Dependent Current Density Functional Theory. [Masters Thesis]. Brigham Young University; 2010. Available from: https://scholarsarchive.byu.edu/cgi/viewcontent.cgi?article=3558&context=etd


Purdue University

5. Jensen, Daniel Spencer. Density-to-Potential Inversions in Density Functional Theory.

Degree: PhD, Physics & Astronomy, 2016, Purdue University

Density functional theory and many of its extensions are formally exact quantum many-body theories. In practice, however, implementations of these theories use approximations for all… (more)

Subjects/Keywords: density functional theory; inverse problems; PDE-constrained optimization; time-dependent density functional theory

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APA (6th Edition):

Jensen, D. S. (2016). Density-to-Potential Inversions in Density Functional Theory. (Doctoral Dissertation). Purdue University. Retrieved from https://docs.lib.purdue.edu/open_access_dissertations/1387

Chicago Manual of Style (16th Edition):

Jensen, Daniel Spencer. “Density-to-Potential Inversions in Density Functional Theory.” 2016. Doctoral Dissertation, Purdue University. Accessed September 26, 2020. https://docs.lib.purdue.edu/open_access_dissertations/1387.

MLA Handbook (7th Edition):

Jensen, Daniel Spencer. “Density-to-Potential Inversions in Density Functional Theory.” 2016. Web. 26 Sep 2020.

Vancouver:

Jensen DS. Density-to-Potential Inversions in Density Functional Theory. [Internet] [Doctoral dissertation]. Purdue University; 2016. [cited 2020 Sep 26]. Available from: https://docs.lib.purdue.edu/open_access_dissertations/1387.

Council of Science Editors:

Jensen DS. Density-to-Potential Inversions in Density Functional Theory. [Doctoral Dissertation]. Purdue University; 2016. Available from: https://docs.lib.purdue.edu/open_access_dissertations/1387


University of Washington

6. Peng, Bo. Towards Accurate and Efficient Description of Excited States.

Degree: PhD, 2016, University of Washington

 The microscopic and molecular-level characterization and understanding of excited states properties and dynamics plays an important role in modern scientic research. Tremendous examples can be… (more)

Subjects/Keywords: Coupled-Cluster; Density Functional Theory; Excited States; Time-Dependent Density Functional Theory; Physical chemistry; chemistry

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APA (6th Edition):

Peng, B. (2016). Towards Accurate and Efficient Description of Excited States. (Doctoral Dissertation). University of Washington. Retrieved from http://hdl.handle.net/1773/36530

Chicago Manual of Style (16th Edition):

Peng, Bo. “Towards Accurate and Efficient Description of Excited States.” 2016. Doctoral Dissertation, University of Washington. Accessed September 26, 2020. http://hdl.handle.net/1773/36530.

MLA Handbook (7th Edition):

Peng, Bo. “Towards Accurate and Efficient Description of Excited States.” 2016. Web. 26 Sep 2020.

Vancouver:

Peng B. Towards Accurate and Efficient Description of Excited States. [Internet] [Doctoral dissertation]. University of Washington; 2016. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1773/36530.

Council of Science Editors:

Peng B. Towards Accurate and Efficient Description of Excited States. [Doctoral Dissertation]. University of Washington; 2016. Available from: http://hdl.handle.net/1773/36530


The Ohio State University

7. Zhu, Ying. A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response.

Degree: MS, Chemical Physics, 2016, The Ohio State University

 We present a method to calculate the excited electronic structure of chemical systems via a real-time approach by using time-dependent density functional theory (TDDFT), i.e.… (more)

Subjects/Keywords: Physical Chemistry; real-time time-dependent density functional theory; RT-TDDFT

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APA (6th Edition):

Zhu, Y. (2016). A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response. (Masters Thesis). The Ohio State University. Retrieved from http://rave.ohiolink.edu/etdc/view?acc_num=osu1460554444

Chicago Manual of Style (16th Edition):

Zhu, Ying. “A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response.” 2016. Masters Thesis, The Ohio State University. Accessed September 26, 2020. http://rave.ohiolink.edu/etdc/view?acc_num=osu1460554444.

MLA Handbook (7th Edition):

Zhu, Ying. “A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response.” 2016. Web. 26 Sep 2020.

Vancouver:

Zhu Y. A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response. [Internet] [Masters thesis]. The Ohio State University; 2016. [cited 2020 Sep 26]. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1460554444.

Council of Science Editors:

Zhu Y. A Comparison of Calculation by Real-Time and by Linear-Response Time-Dependent Density Functional Theory in the Regime of Linear Optical Response. [Masters Thesis]. The Ohio State University; 2016. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1460554444


The Ohio State University

8. Richard, Ryan M. Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons.

Degree: MS, Chemistry, 2011, The Ohio State University

 The electronic spectrum of alternant polycyclic aromatic hydrocarbons (PAHs) includes two singlet excited states that are often denoted 1La and 1Lb. Time-dependent density functional theory(more)

Subjects/Keywords: Physical Chemistry; Time-Dependent Density Functional Theory; Polycyclic Aromatic Hydrocarbons

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APA (6th Edition):

Richard, R. M. (2011). Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons. (Masters Thesis). The Ohio State University. Retrieved from http://rave.ohiolink.edu/etdc/view?acc_num=osu1302098974

Chicago Manual of Style (16th Edition):

Richard, Ryan M. “Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons.” 2011. Masters Thesis, The Ohio State University. Accessed September 26, 2020. http://rave.ohiolink.edu/etdc/view?acc_num=osu1302098974.

MLA Handbook (7th Edition):

Richard, Ryan M. “Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons.” 2011. Web. 26 Sep 2020.

Vancouver:

Richard RM. Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons. [Internet] [Masters thesis]. The Ohio State University; 2011. [cited 2020 Sep 26]. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1302098974.

Council of Science Editors:

Richard RM. Time-Dependent Density-Functional Description of the 1La State in Polycyclic Aromatic Hydrocarbons. [Masters Thesis]. The Ohio State University; 2011. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1302098974


University of Tennessee – Knoxville

9. Sundahl, Bryan Edman. Time Dependent Density-Functional Theory - Linear Response.

Degree: MS, Chemistry, 2013, University of Tennessee – Knoxville

  The formal derivation of the linear response of time-dependent density-functional theory as shown by E. K. U. Gross is presented. The transformation of formal… (more)

Subjects/Keywords: electronic structure; linear response; time-dependent density-functional theory; Physical Chemistry

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APA (6th Edition):

Sundahl, B. E. (2013). Time Dependent Density-Functional Theory - Linear Response. (Thesis). University of Tennessee – Knoxville. Retrieved from https://trace.tennessee.edu/utk_gradthes/2644

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):

Sundahl, Bryan Edman. “Time Dependent Density-Functional Theory - Linear Response.” 2013. Thesis, University of Tennessee – Knoxville. Accessed September 26, 2020. https://trace.tennessee.edu/utk_gradthes/2644.

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

MLA Handbook (7th Edition):

Sundahl, Bryan Edman. “Time Dependent Density-Functional Theory - Linear Response.” 2013. Web. 26 Sep 2020.

Vancouver:

Sundahl BE. Time Dependent Density-Functional Theory - Linear Response. [Internet] [Thesis]. University of Tennessee – Knoxville; 2013. [cited 2020 Sep 26]. Available from: https://trace.tennessee.edu/utk_gradthes/2644.

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

Council of Science Editors:

Sundahl BE. Time Dependent Density-Functional Theory - Linear Response. [Thesis]. University of Tennessee – Knoxville; 2013. Available from: https://trace.tennessee.edu/utk_gradthes/2644

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

10. Fojt, Jakub. Hot-carrier generation and transfer across nanoparticle-molecule interfaces .

Degree: Chalmers tekniska högskola / Institutionen för fysik, 2020, Chalmers University of Technology

 Metallic nanoparticles are important materials for emerging sensing and catalysis technologies. Their special properties stem from the presence of a localized surface plasmon resonance (LSPR)… (more)

Subjects/Keywords: Hot-carriers; localized surface plasmon resonance; time-dependent density functional theory

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APA (6th Edition):

Fojt, J. (2020). Hot-carrier generation and transfer across nanoparticle-molecule interfaces . (Thesis). Chalmers University of Technology. Retrieved from http://hdl.handle.net/20.500.12380/301432

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):

Fojt, Jakub. “Hot-carrier generation and transfer across nanoparticle-molecule interfaces .” 2020. Thesis, Chalmers University of Technology. Accessed September 26, 2020. http://hdl.handle.net/20.500.12380/301432.

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

MLA Handbook (7th Edition):

Fojt, Jakub. “Hot-carrier generation and transfer across nanoparticle-molecule interfaces .” 2020. Web. 26 Sep 2020.

Vancouver:

Fojt J. Hot-carrier generation and transfer across nanoparticle-molecule interfaces . [Internet] [Thesis]. Chalmers University of Technology; 2020. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/20.500.12380/301432.

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

Council of Science Editors:

Fojt J. Hot-carrier generation and transfer across nanoparticle-molecule interfaces . [Thesis]. Chalmers University of Technology; 2020. Available from: http://hdl.handle.net/20.500.12380/301432

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


University of Newcastle

11. Burgess, Robertson Wesley. A TDDFT study of the optical absorption spectra of gold and silver clusters.

Degree: PhD, 2012, University of Newcastle

Research Doctorate - Doctor of Philosophy (PhD)

The absorption cross-section over the optical range of frequencies of gold and silver clusters of up to 171… (more)

Subjects/Keywords: TDDFT; gold; silver; DFT; Time Dependent Density Functional Theory; Density Functional Theory; nanoparticles; clusters; optical properties; absorption cross-section

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APA (6th Edition):

Burgess, R. W. (2012). A TDDFT study of the optical absorption spectra of gold and silver clusters. (Doctoral Dissertation). University of Newcastle. Retrieved from http://hdl.handle.net/1959.13/936786

Chicago Manual of Style (16th Edition):

Burgess, Robertson Wesley. “A TDDFT study of the optical absorption spectra of gold and silver clusters.” 2012. Doctoral Dissertation, University of Newcastle. Accessed September 26, 2020. http://hdl.handle.net/1959.13/936786.

MLA Handbook (7th Edition):

Burgess, Robertson Wesley. “A TDDFT study of the optical absorption spectra of gold and silver clusters.” 2012. Web. 26 Sep 2020.

Vancouver:

Burgess RW. A TDDFT study of the optical absorption spectra of gold and silver clusters. [Internet] [Doctoral dissertation]. University of Newcastle; 2012. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1959.13/936786.

Council of Science Editors:

Burgess RW. A TDDFT study of the optical absorption spectra of gold and silver clusters. [Doctoral Dissertation]. University of Newcastle; 2012. Available from: http://hdl.handle.net/1959.13/936786

12. ORHAN, OKAN KARACA. Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems.

Degree: School of Physics. Discipline of Physics, 2018, Trinity College Dublin

Density-functional theory within its practical, widespread Kohn-Sham formalism (KS-DFT), is an effective approach for providing the starting point for advanced first-principles spectroscopy simulations of molecules… (more)

Subjects/Keywords: time-dependent density-functional theory; density-functional theory; GW approximation; Hubbard correction; transition-metals; theoretical spectroscopy

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APA (6th Edition):

ORHAN, O. K. (2018). Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems. (Thesis). Trinity College Dublin. Retrieved from http://hdl.handle.net/2262/84975

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):

ORHAN, OKAN KARACA. “Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems.” 2018. Thesis, Trinity College Dublin. Accessed September 26, 2020. http://hdl.handle.net/2262/84975.

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

MLA Handbook (7th Edition):

ORHAN, OKAN KARACA. “Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems.” 2018. Web. 26 Sep 2020.

Vancouver:

ORHAN OK. Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems. [Internet] [Thesis]. Trinity College Dublin; 2018. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/2262/84975.

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

Council of Science Editors:

ORHAN OK. Corrective First-Principles Approaches for the Theoretical Spectroscopy of Transition-Metal Systems. [Thesis]. Trinity College Dublin; 2018. Available from: http://hdl.handle.net/2262/84975

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


Vrije Universiteit Amsterdam

13. Meer, R. van. Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories .

Degree: 2015, Vrije Universiteit Amsterdam

Subjects/Keywords: (Time-Dependent) Density Functional Theory; (Time-Dependent) Density Matrix Functional Theory

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APA (6th Edition):

Meer, R. v. (2015). Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories . (Doctoral Dissertation). Vrije Universiteit Amsterdam. Retrieved from http://hdl.handle.net/1871/53347

Chicago Manual of Style (16th Edition):

Meer, R van. “Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories .” 2015. Doctoral Dissertation, Vrije Universiteit Amsterdam. Accessed September 26, 2020. http://hdl.handle.net/1871/53347.

MLA Handbook (7th Edition):

Meer, R van. “Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories .” 2015. Web. 26 Sep 2020.

Vancouver:

Meer Rv. Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories . [Internet] [Doctoral dissertation]. Vrije Universiteit Amsterdam; 2015. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1871/53347.

Council of Science Editors:

Meer Rv. Physical Meaning of Orbitals in Adiabatic Linear Response Time-Dependent Orbital Functional Theories . [Doctoral Dissertation]. Vrije Universiteit Amsterdam; 2015. Available from: http://hdl.handle.net/1871/53347

14. Lacombe, Lionel. On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps.

Degree: Docteur es, Physique de la matière, 2016, Université Toulouse III – Paul Sabatier

Cette thèse présente différentes approches quantiques pour l'exploration de processus dynamiques dans des systèmes multiélectroniques, en particulier après une forte excitation qui peut aboutir à… (more)

Subjects/Keywords: Théorie de la fonctionnelle de la densité; Matrice densité; Extended time-dependent Hartree-Fock; Stochastic time-dependent Hartree-Fock; Collisional time-dependent Hartree-Fock; Effets dissipatifs; Au-delà du champ moyen; Density Functional Theory; Density Functional Theory; Density Functional Theory; Density Functional Theory; Density Functional Theory; Dissipative effects; Dissipative effects

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APA (6th Edition):

Lacombe, L. (2016). On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps. (Doctoral Dissertation). Université Toulouse III – Paul Sabatier. Retrieved from http://www.theses.fr/2016TOU30185

Chicago Manual of Style (16th Edition):

Lacombe, Lionel. “On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps.” 2016. Doctoral Dissertation, Université Toulouse III – Paul Sabatier. Accessed September 26, 2020. http://www.theses.fr/2016TOU30185.

MLA Handbook (7th Edition):

Lacombe, Lionel. “On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps.” 2016. Web. 26 Sep 2020.

Vancouver:

Lacombe L. On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps. [Internet] [Doctoral dissertation]. Université Toulouse III – Paul Sabatier; 2016. [cited 2020 Sep 26]. Available from: http://www.theses.fr/2016TOU30185.

Council of Science Editors:

Lacombe L. On dynamics beyond time-dependent mean-field theories : Dynamique au-delà des théories de champ moyen dépendant du temps. [Doctoral Dissertation]. Université Toulouse III – Paul Sabatier; 2016. Available from: http://www.theses.fr/2016TOU30185


Penn State University

15. Silverstein, Daniel William. Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes.

Degree: 2013, Penn State University

 The interaction of radiation with matter allows many interesting properties of a molecule or material to be quantified. When the incident radiation is energetically tuned… (more)

Subjects/Keywords: Time-Dependent Density Functional Theory; Linear Optical Properties; Nonlinear Optical Properties; Raman Scattering

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APA (6th Edition):

Silverstein, D. W. (2013). Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes. (Thesis). Penn State University. Retrieved from https://submit-etda.libraries.psu.edu/catalog/19001

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):

Silverstein, Daniel William. “Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes.” 2013. Thesis, Penn State University. Accessed September 26, 2020. https://submit-etda.libraries.psu.edu/catalog/19001.

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

MLA Handbook (7th Edition):

Silverstein, Daniel William. “Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes.” 2013. Web. 26 Sep 2020.

Vancouver:

Silverstein DW. Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes. [Internet] [Thesis]. Penn State University; 2013. [cited 2020 Sep 26]. Available from: https://submit-etda.libraries.psu.edu/catalog/19001.

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

Council of Science Editors:

Silverstein DW. Applications of Time-dependent Quantum Mechanics to Resonantly-enhanced Linear and Nonlinear Optical Processes. [Thesis]. Penn State University; 2013. Available from: https://submit-etda.libraries.psu.edu/catalog/19001

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


George Mason University

16. Massaro, Richard Douglas. Photoluminescent Organic Molecules from the Perspective of Density Functional Theory .

Degree: 2011, George Mason University

 I have studied the electronic structure, vibrational modes, and photophysics of methyl salicylate (MS) isomers in detail using density functional theory (DFT) and its timedependent… (more)

Subjects/Keywords: density functional theory; dipicolinic acid; photoluminescence; vibrational spectrum; methyl salicylate; time-dependent DFT

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APA (6th Edition):

Massaro, R. D. (2011). Photoluminescent Organic Molecules from the Perspective of Density Functional Theory . (Thesis). George Mason University. Retrieved from http://hdl.handle.net/1920/6314

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):

Massaro, Richard Douglas. “Photoluminescent Organic Molecules from the Perspective of Density Functional Theory .” 2011. Thesis, George Mason University. Accessed September 26, 2020. http://hdl.handle.net/1920/6314.

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

MLA Handbook (7th Edition):

Massaro, Richard Douglas. “Photoluminescent Organic Molecules from the Perspective of Density Functional Theory .” 2011. Web. 26 Sep 2020.

Vancouver:

Massaro RD. Photoluminescent Organic Molecules from the Perspective of Density Functional Theory . [Internet] [Thesis]. George Mason University; 2011. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1920/6314.

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

Council of Science Editors:

Massaro RD. Photoluminescent Organic Molecules from the Perspective of Density Functional Theory . [Thesis]. George Mason University; 2011. Available from: http://hdl.handle.net/1920/6314

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


University of Notre Dame

17. Triet S. Nguyen-Beck. Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>.

Degree: Chemistry and Biochemistry, 2018, University of Notre Dame

  Many fundamental processes in nature and technology, from the electronic energy transfer in biological photosynthetic complexes to the charge mobility in solid-state photovoltaic devices,… (more)

Subjects/Keywords: Quantum dynamics; theoretical chemistry; quantum chemistry; Time-dependent density functional theory; physical chemistry; computational chemistry

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APA (6th Edition):

Nguyen-Beck, T. S. (2018). Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>. (Thesis). University of Notre Dame. Retrieved from https://curate.nd.edu/show/gm80ht27s6q

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):

Nguyen-Beck, Triet S.. “Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>.” 2018. Thesis, University of Notre Dame. Accessed September 26, 2020. https://curate.nd.edu/show/gm80ht27s6q.

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

MLA Handbook (7th Edition):

Nguyen-Beck, Triet S.. “Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>.” 2018. Web. 26 Sep 2020.

Vancouver:

Nguyen-Beck TS. Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>. [Internet] [Thesis]. University of Notre Dame; 2018. [cited 2020 Sep 26]. Available from: https://curate.nd.edu/show/gm80ht27s6q.

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

Council of Science Editors:

Nguyen-Beck TS. Development and Applications of the Real-Time Electronic Dynamics Method OSCF2</h1>. [Thesis]. University of Notre Dame; 2018. Available from: https://curate.nd.edu/show/gm80ht27s6q

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


Kansas State University

18. Karimova, Natalia Vladimirovna. Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy.

Degree: PhD, Department of Chemistry, 2017, Kansas State University

 Gold and silver particles with dimensions less than a nanometer possess unique characteristics and properties that are different from the properties of the bulk. They… (more)

Subjects/Keywords: Time-dependent density functional theory; Optical properties; Gold nanoparticles; Silver nanoparticles; Chirality; Localized surface plasmon

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APA (6th Edition):

Karimova, N. V. (2017). Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy. (Doctoral Dissertation). Kansas State University. Retrieved from http://hdl.handle.net/2097/38177

Chicago Manual of Style (16th Edition):

Karimova, Natalia Vladimirovna. “Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy.” 2017. Doctoral Dissertation, Kansas State University. Accessed September 26, 2020. http://hdl.handle.net/2097/38177.

MLA Handbook (7th Edition):

Karimova, Natalia Vladimirovna. “Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy.” 2017. Web. 26 Sep 2020.

Vancouver:

Karimova NV. Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy. [Internet] [Doctoral dissertation]. Kansas State University; 2017. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/2097/38177.

Council of Science Editors:

Karimova NV. Theoretical study of the optical properties of the noble metal nanoparticles: CD and MCD spectroscopy. [Doctoral Dissertation]. Kansas State University; 2017. Available from: http://hdl.handle.net/2097/38177


Kansas State University

19. Weerawardene, K. L. Dimuthu M. Optical and luminescence properties of noble metal nanoparticles.

Degree: PhD, Department of Chemistry, 2017, Kansas State University

 The remarkable optical and luminescence properties of noble metal nanoparticles (with diameters < 2 nm) attract researchers due to potential applications in biomedicine, photocatalysis, and… (more)

Subjects/Keywords: Gold and Silver nanoparticles; Luminescence; Time-dependent density functional theory; Optical properties

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APA (6th Edition):

Weerawardene, K. L. D. M. (2017). Optical and luminescence properties of noble metal nanoparticles. (Doctoral Dissertation). Kansas State University. Retrieved from http://hdl.handle.net/2097/38189

Chicago Manual of Style (16th Edition):

Weerawardene, K L Dimuthu M. “Optical and luminescence properties of noble metal nanoparticles.” 2017. Doctoral Dissertation, Kansas State University. Accessed September 26, 2020. http://hdl.handle.net/2097/38189.

MLA Handbook (7th Edition):

Weerawardene, K L Dimuthu M. “Optical and luminescence properties of noble metal nanoparticles.” 2017. Web. 26 Sep 2020.

Vancouver:

Weerawardene KLDM. Optical and luminescence properties of noble metal nanoparticles. [Internet] [Doctoral dissertation]. Kansas State University; 2017. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/2097/38189.

Council of Science Editors:

Weerawardene KLDM. Optical and luminescence properties of noble metal nanoparticles. [Doctoral Dissertation]. Kansas State University; 2017. Available from: http://hdl.handle.net/2097/38189


University of Michigan

20. Kanungo, Bikash. All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations.

Degree: PhD, Mechanical Engineering, 2019, University of Michigan

Density functional theory (DFT), in its ground-state as well as time-dependent variant, have enjoyed incredible success in predicting a range of physical, chemical and materials… (more)

Subjects/Keywords: Density functional theory; Time dependent density functional theory; All electron density functional theory; Inverse density functional theory; Exchange-correlation; Electronic structure; Materials Science and Engineering; Mechanical Engineering; Chemistry; Mathematics; Physics; Engineering; Science

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APA (6th Edition):

Kanungo, B. (2019). All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations. (Doctoral Dissertation). University of Michigan. Retrieved from http://hdl.handle.net/2027.42/153371

Chicago Manual of Style (16th Edition):

Kanungo, Bikash. “All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations.” 2019. Doctoral Dissertation, University of Michigan. Accessed September 26, 2020. http://hdl.handle.net/2027.42/153371.

MLA Handbook (7th Edition):

Kanungo, Bikash. “All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations.” 2019. Web. 26 Sep 2020.

Vancouver:

Kanungo B. All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations. [Internet] [Doctoral dissertation]. University of Michigan; 2019. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/2027.42/153371.

Council of Science Editors:

Kanungo B. All-Electron Ground-State and Time-Dependent Density Functional Theory: Fast Algorithms and Better Approximations. [Doctoral Dissertation]. University of Michigan; 2019. Available from: http://hdl.handle.net/2027.42/153371


The Ohio State University

21. Drummond, Michael L. Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls.

Degree: PhD, Chemistry, 2005, The Ohio State University

 In this dissertation, various dinuclear organometallic carbonyls (DOCs) – that is, compounds containing two metal atom centers, each bonded to one or more CO ligands… (more)

Subjects/Keywords: Computational Chemistry; Inorganic Chemistry; Density Functional Theory; Photochemistry; Time-Dependent Density Functional Theory

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APA (6th Edition):

Drummond, M. L. (2005). Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls. (Doctoral Dissertation). The Ohio State University. Retrieved from http://rave.ohiolink.edu/etdc/view?acc_num=osu1104284754

Chicago Manual of Style (16th Edition):

Drummond, Michael L. “Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls.” 2005. Doctoral Dissertation, The Ohio State University. Accessed September 26, 2020. http://rave.ohiolink.edu/etdc/view?acc_num=osu1104284754.

MLA Handbook (7th Edition):

Drummond, Michael L. “Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls.” 2005. Web. 26 Sep 2020.

Vancouver:

Drummond ML. Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls. [Internet] [Doctoral dissertation]. The Ohio State University; 2005. [cited 2020 Sep 26]. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1104284754.

Council of Science Editors:

Drummond ML. Denisty functional theory investigations of the ground- and excited-state chemistry of dinuclear organometallic carbonyls. [Doctoral Dissertation]. The Ohio State University; 2005. Available from: http://rave.ohiolink.edu/etdc/view?acc_num=osu1104284754

22. Sinha Roy, Rajarshi. Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques.

Degree: Docteur es, Sciences des Matériaux, Physique, Chimie et Nanosciences, 2018, Aix-Marseille; Universidad autónoma de Madrid. Departamento de Física Teórica

L'intérêt de la recherche fondamentale pour les morceaux nanométriques de métaux nobles est principalement dû à la résonance localisée des plasmons de surface (LSPR) dans… (more)

Subjects/Keywords: .; Localized plasmon resonance; D-Electron excitations; Time-Dependent density−functional theory; Ab initio methods; Classical optics; Nanorod; Atomic chain; 530

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APA (6th Edition):

Sinha Roy, R. (2018). Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques. (Doctoral Dissertation). Aix-Marseille; Universidad autónoma de Madrid. Departamento de Física Teórica. Retrieved from http://www.theses.fr/2018AIXM0017

Chicago Manual of Style (16th Edition):

Sinha Roy, Rajarshi. “Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques.” 2018. Doctoral Dissertation, Aix-Marseille; Universidad autónoma de Madrid. Departamento de Física Teórica. Accessed September 26, 2020. http://www.theses.fr/2018AIXM0017.

MLA Handbook (7th Edition):

Sinha Roy, Rajarshi. “Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques.” 2018. Web. 26 Sep 2020.

Vancouver:

Sinha Roy R. Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques. [Internet] [Doctoral dissertation]. Aix-Marseille; Universidad autónoma de Madrid. Departamento de Física Teórica; 2018. [cited 2020 Sep 26]. Available from: http://www.theses.fr/2018AIXM0017.

Council of Science Editors:

Sinha Roy R. Ab initio simulation of optical properties of noble-metal clusters : Modélisation des propriétés optiques de nanoparticules métalliques. [Doctoral Dissertation]. Aix-Marseille; Universidad autónoma de Madrid. Departamento de Física Teórica; 2018. Available from: http://www.theses.fr/2018AIXM0017


Freie Universität Berlin

23. Singh, Nisha. Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen.

Degree: 2019, Freie Universität Berlin

 Niederenergetische Anregungen (<1 eV) sind für das Verständnis der elektronischen, mag- netischen und thermodynamischen Eigenschaften eines Materials von größter Bedeutung. Die kollektiven Anregungen des Spins… (more)

Subjects/Keywords: Time-Dependent Density Functional Theory; Magnons; Magnon manipulation with laser; 500 Natural sciences and mathematics::530 Physics::538 Magnetism

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APA (6th Edition):

Singh, N. (2019). Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen. (Thesis). Freie Universität Berlin. Retrieved from http://dx.doi.org/10.17169/refubium-25791

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):

Singh, Nisha. “Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen.” 2019. Thesis, Freie Universität Berlin. Accessed September 26, 2020. http://dx.doi.org/10.17169/refubium-25791.

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

MLA Handbook (7th Edition):

Singh, Nisha. “Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen.” 2019. Web. 26 Sep 2020.

Vancouver:

Singh N. Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen. [Internet] [Thesis]. Freie Universität Berlin; 2019. [cited 2020 Sep 26]. Available from: http://dx.doi.org/10.17169/refubium-25791.

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

Council of Science Editors:

Singh N. Ab-initio-Studie von Magnonen in linearen und nichtlinearen Regimen. [Thesis]. Freie Universität Berlin; 2019. Available from: http://dx.doi.org/10.17169/refubium-25791

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


University of Lund

24. Vettchinkina, Valeria. Transport phenomena in quantum wells and wires in presence of disorder and interactions.

Degree: 2012, University of Lund

 Present-day electronics employ circuits of smaller and smaller dimensions, and today the length scales are so small that the laws of physics which rule micro-cosmos,… (more)

Subjects/Keywords: Condensed Matter Physics; time-dependent density-functional theory; disorder; electron correlation; Lowdimensional semiconducting systems; transport phenomena; Fysicumarkivet F:2012:Vettchinkina

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APA (6th Edition):

Vettchinkina, V. (2012). Transport phenomena in quantum wells and wires in presence of disorder and interactions. (Doctoral Dissertation). University of Lund. Retrieved from https://lup.lub.lu.se/record/2520291 ; https://portal.research.lu.se/ws/files/5700002/2520352.pdf

Chicago Manual of Style (16th Edition):

Vettchinkina, Valeria. “Transport phenomena in quantum wells and wires in presence of disorder and interactions.” 2012. Doctoral Dissertation, University of Lund. Accessed September 26, 2020. https://lup.lub.lu.se/record/2520291 ; https://portal.research.lu.se/ws/files/5700002/2520352.pdf.

MLA Handbook (7th Edition):

Vettchinkina, Valeria. “Transport phenomena in quantum wells and wires in presence of disorder and interactions.” 2012. Web. 26 Sep 2020.

Vancouver:

Vettchinkina V. Transport phenomena in quantum wells and wires in presence of disorder and interactions. [Internet] [Doctoral dissertation]. University of Lund; 2012. [cited 2020 Sep 26]. Available from: https://lup.lub.lu.se/record/2520291 ; https://portal.research.lu.se/ws/files/5700002/2520352.pdf.

Council of Science Editors:

Vettchinkina V. Transport phenomena in quantum wells and wires in presence of disorder and interactions. [Doctoral Dissertation]. University of Lund; 2012. Available from: https://lup.lub.lu.se/record/2520291 ; https://portal.research.lu.se/ws/files/5700002/2520352.pdf


University of Tennessee – Knoxville

25. Van Wesep, Robert Gerard. Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models.

Degree: 2016, University of Tennessee – Knoxville

 Understanding the role of local orbital degrees of freedom in the behavior of solid state systems has long been understood as a key to unraveling… (more)

Subjects/Keywords: Solid State Physics; Condensed Matter Physics; Time-Dependent Density Functional Theory; Wannier Functions; Copper Oxides; Iron-based Superconductors; Condensed Matter Physics

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APA (6th Edition):

Van Wesep, R. G. (2016). Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models. (Doctoral Dissertation). University of Tennessee – Knoxville. Retrieved from https://trace.tennessee.edu/utk_graddiss/4112

Chicago Manual of Style (16th Edition):

Van Wesep, Robert Gerard. “Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models.” 2016. Doctoral Dissertation, University of Tennessee – Knoxville. Accessed September 26, 2020. https://trace.tennessee.edu/utk_graddiss/4112.

MLA Handbook (7th Edition):

Van Wesep, Robert Gerard. “Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models.” 2016. Web. 26 Sep 2020.

Vancouver:

Van Wesep RG. Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models. [Internet] [Doctoral dissertation]. University of Tennessee – Knoxville; 2016. [cited 2020 Sep 26]. Available from: https://trace.tennessee.edu/utk_graddiss/4112.

Council of Science Editors:

Van Wesep RG. Optical Spectroscopy and the Contruction of an Optimal Wannier Basis with Application to the Development of <i>Ab Initio</i> Models. [Doctoral Dissertation]. University of Tennessee – Knoxville; 2016. Available from: https://trace.tennessee.edu/utk_graddiss/4112


University of Washington

26. Ding, Feizhi. Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods.

Degree: PhD, 2015, University of Washington

 Understanding electronic behavior in molecular and nano-scale systems is fundamental to the development and design of novel technologies and materials for application in a variety… (more)

Subjects/Keywords: Density Functional Theory; Electronic Structure Theory; Hartree-Fock; Many-electron dynamics; Multi-Configuration Self-Consistent Field Theory; Time-dependent; Chemistry; Physical chemistry; chemistry

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APA (6th Edition):

Ding, F. (2015). Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods. (Doctoral Dissertation). University of Washington. Retrieved from http://hdl.handle.net/1773/33655

Chicago Manual of Style (16th Edition):

Ding, Feizhi. “Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods.” 2015. Doctoral Dissertation, University of Washington. Accessed September 26, 2020. http://hdl.handle.net/1773/33655.

MLA Handbook (7th Edition):

Ding, Feizhi. “Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods.” 2015. Web. 26 Sep 2020.

Vancouver:

Ding F. Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods. [Internet] [Doctoral dissertation]. University of Washington; 2015. [cited 2020 Sep 26]. Available from: http://hdl.handle.net/1773/33655.

Council of Science Editors:

Ding F. Towards Efficient and Accurate Description of Many-Electron Problems: Developments of Static and Time-Dependent Electronic Structure Methods. [Doctoral Dissertation]. University of Washington; 2015. Available from: http://hdl.handle.net/1773/33655


Penn State University

27. Hu, Zhongwei. ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES.

Degree: 2017, Penn State University

 Spectroscopy, the study of interactions between radiation and matter, often becomes more complicated for intense radiation due to the cause of nonlinearity. At the molecular… (more)

Subjects/Keywords: Time-Dependent Density Functional Theory; Damped Response Theory; Nonlinear Optical Properties; Hyper-Rayleigh Scattering; Hyper-Raman Scattering; Two-Photon Absorption; Surface-Enhanced Hyper-Raman Scattering

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APA (6th Edition):

Hu, Z. (2017). ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES. (Thesis). Penn State University. Retrieved from https://submit-etda.libraries.psu.edu/catalog/14557zxh120

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):

Hu, Zhongwei. “ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES.” 2017. Thesis, Penn State University. Accessed September 26, 2020. https://submit-etda.libraries.psu.edu/catalog/14557zxh120.

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

MLA Handbook (7th Edition):

Hu, Zhongwei. “ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES.” 2017. Web. 26 Sep 2020.

Vancouver:

Hu Z. ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES. [Internet] [Thesis]. Penn State University; 2017. [cited 2020 Sep 26]. Available from: https://submit-etda.libraries.psu.edu/catalog/14557zxh120.

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

Council of Science Editors:

Hu Z. ATOMISTIC ELECTRODYNAMICS-QUANTUM MECHANICAL METHODS TO MODEL SURFACE-ENHANCED NONLINEAR OPTICAL SPECTROSCOPIES. [Thesis]. Penn State University; 2017. Available from: https://submit-etda.libraries.psu.edu/catalog/14557zxh120

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

28. Vieira, Daniel. Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos.

Degree: PhD, Física Básica, 2010, University of São Paulo

Neste trabalho utilizamos sistemas modelos no desenvolvimento, implementação e análise de funcionais orbitais da densidade, focando, em particular, nas correções de autointeração de Perdew-Zunger (PZSIC)… (more)

Subjects/Keywords: Correções de auto-interação; Density functional theory; Funcionais orbitais da densidade; Hubbard model. Semiconductor quantum wells; Modelo de Hubbard; Orbitaldependent density functionals; Poços quânticos semicondutores; Self-interaction corrections; Teoria do funcional da densidade; Teoria do funcional da densidade dependente do tempo; Time-dependent density functional theory

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APA (6th Edition):

Vieira, D. (2010). Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos. (Doctoral Dissertation). University of São Paulo. Retrieved from http://www.teses.usp.br/teses/disponiveis/76/76131/tde-23042010-101040/ ;

Chicago Manual of Style (16th Edition):

Vieira, Daniel. “Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos.” 2010. Doctoral Dissertation, University of São Paulo. Accessed September 26, 2020. http://www.teses.usp.br/teses/disponiveis/76/76131/tde-23042010-101040/ ;.

MLA Handbook (7th Edition):

Vieira, Daniel. “Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos.” 2010. Web. 26 Sep 2020.

Vancouver:

Vieira D. Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos. [Internet] [Doctoral dissertation]. University of São Paulo; 2010. [cited 2020 Sep 26]. Available from: http://www.teses.usp.br/teses/disponiveis/76/76131/tde-23042010-101040/ ;.

Council of Science Editors:

Vieira D. Correções de auto-interação na teoria do funcional da densidade: investigação em modelos de sistemas de muitos corpos. [Doctoral Dissertation]. University of São Paulo; 2010. Available from: http://www.teses.usp.br/teses/disponiveis/76/76131/tde-23042010-101040/ ;

29. Magero, Denis. Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium.

Degree: Docteur es, Chimie physique moléculaire et structurale, 2017, Université Grenoble Alpes (ComUE)

Cette thèse fait partie d’un projet franco-keyan dénommé ELEPHOX (ELEctrochemical and PHOto Properties of Some Remarkable Ruthenium and Iron CompleXes). En particulier, notre focus est… (more)

Subjects/Keywords: Photochimie; Chimie Quantique; Complexes polypyridine de ruthénium; Densité d'états partielle; Théorie de la fonctionnelle de la densité; Théorie de la fonctionnelle de la densité dépendante du temps; Photochemistry; Quantum Chemistry; Polypyridine ruthenium complexes; Partial density of states; Density-Functional theory; Time-Dependent density-Functional theory; 540; 530

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

APA (6th Edition):

Magero, D. (2017). Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium. (Doctoral Dissertation). Université Grenoble Alpes (ComUE). Retrieved from http://www.theses.fr/2017GREAV071

Chicago Manual of Style (16th Edition):

Magero, Denis. “Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium.” 2017. Doctoral Dissertation, Université Grenoble Alpes (ComUE). Accessed September 26, 2020. http://www.theses.fr/2017GREAV071.

MLA Handbook (7th Edition):

Magero, Denis. “Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium.” 2017. Web. 26 Sep 2020.

Vancouver:

Magero D. Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium. [Internet] [Doctoral dissertation]. Université Grenoble Alpes (ComUE); 2017. [cited 2020 Sep 26]. Available from: http://www.theses.fr/2017GREAV071.

Council of Science Editors:

Magero D. Electrochemical and photochemical studies of some remarkable ruthenium complexes : Etude théorique des propriétés électro et photochimique des complexes de ruthénium. [Doctoral Dissertation]. Université Grenoble Alpes (ComUE); 2017. Available from: http://www.theses.fr/2017GREAV071


University of California – San Diego

30. Freeman, Lindsay Michelle. Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites.

Degree: Chemical Engineering, 2016, University of California – San Diego

 Although surface-enhanced Raman spectroscopy (SERS) has been a valuable tool for chemical detection, the understanding of the contributions of the chemical enhancement effect in nucleic… (more)

Subjects/Keywords: Chemical engineering; Optics; Electrical engineering; charge-transfer; nucleic acids; raman spectroscopy; silver composites; surface-enhanced raman spectroscopy; time-dependent density functional theory

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

APA (6th Edition):

Freeman, L. M. (2016). Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites. (Thesis). University of California – San Diego. Retrieved from http://www.escholarship.org/uc/item/523837fk

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):

Freeman, Lindsay Michelle. “Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites.” 2016. Thesis, University of California – San Diego. Accessed September 26, 2020. http://www.escholarship.org/uc/item/523837fk.

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

MLA Handbook (7th Edition):

Freeman, Lindsay Michelle. “Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites.” 2016. Web. 26 Sep 2020.

Vancouver:

Freeman LM. Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites. [Internet] [Thesis]. University of California – San Diego; 2016. [cited 2020 Sep 26]. Available from: http://www.escholarship.org/uc/item/523837fk.

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

Council of Science Editors:

Freeman LM. Chemical Resonance Effects in Surface-enhanced Raman Scattering of Nucleic Acid-Silver Composites. [Thesis]. University of California – San Diego; 2016. Available from: http://www.escholarship.org/uc/item/523837fk

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

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