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You searched for subject:(semiclassical dynamics). Showing records 1 – 16 of 16 total matches.

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University of Illinois – Urbana-Champaign

1. Wang, Fei. Quantum-classical and semiclassical path integral methods for condensed phase dynamics.

Degree: PhD, Chemistry, 2018, University of Illinois – Urbana-Champaign

 Chemical dynamics are essentially quantum mechanical processes. A great variety of chemical processes such as electron transfer and energy relaxation occur in condensed phase, reactants… (more)

Subjects/Keywords: path integral; semiclassical; condensed phase dynamics

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APA (6th Edition):

Wang, F. (2018). Quantum-classical and semiclassical path integral methods for condensed phase dynamics. (Doctoral Dissertation). University of Illinois – Urbana-Champaign. Retrieved from http://hdl.handle.net/2142/102468

Chicago Manual of Style (16th Edition):

Wang, Fei. “Quantum-classical and semiclassical path integral methods for condensed phase dynamics.” 2018. Doctoral Dissertation, University of Illinois – Urbana-Champaign. Accessed October 18, 2019. http://hdl.handle.net/2142/102468.

MLA Handbook (7th Edition):

Wang, Fei. “Quantum-classical and semiclassical path integral methods for condensed phase dynamics.” 2018. Web. 18 Oct 2019.

Vancouver:

Wang F. Quantum-classical and semiclassical path integral methods for condensed phase dynamics. [Internet] [Doctoral dissertation]. University of Illinois – Urbana-Champaign; 2018. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/2142/102468.

Council of Science Editors:

Wang F. Quantum-classical and semiclassical path integral methods for condensed phase dynamics. [Doctoral Dissertation]. University of Illinois – Urbana-Champaign; 2018. Available from: http://hdl.handle.net/2142/102468


University of California – Berkeley

2. Swenson, David William Howey. Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics.

Degree: Chemistry, 2011, University of California – Berkeley

Semiclassical approaches to chemical dynamics show great promise as methods to obtain practical results for a wide range of problems. In this dissertation we make… (more)

Subjects/Keywords: Chemistry; Physical chemistry; Physics; molecular electronics; semiclassical dynamics

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APA (6th Edition):

Swenson, D. W. H. (2011). Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics. (Thesis). University of California – Berkeley. Retrieved from http://www.escholarship.org/uc/item/99z8g8w8

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):

Swenson, David William Howey. “Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics.” 2011. Thesis, University of California – Berkeley. Accessed October 18, 2019. http://www.escholarship.org/uc/item/99z8g8w8.

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

MLA Handbook (7th Edition):

Swenson, David William Howey. “Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics.” 2011. Web. 18 Oct 2019.

Vancouver:

Swenson DWH. Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics. [Internet] [Thesis]. University of California – Berkeley; 2011. [cited 2019 Oct 18]. Available from: http://www.escholarship.org/uc/item/99z8g8w8.

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

Council of Science Editors:

Swenson DWH. Quantum Effects from Classical Trajectories: New Methodologies and Applications for Semiclassical Dynamics. [Thesis]. University of California – Berkeley; 2011. Available from: http://www.escholarship.org/uc/item/99z8g8w8

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


University of Oregon

3. Kovac, Philip. Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering.

Degree: 2018, University of Oregon

 We present a time-dependent mixed quantum/semiclassical approach to calculating linear absorption spectra. Applying Variational Fixed Vibrational Basis/Gaussian Bath theory (FVB/GB) to the treatment of small… (more)

Subjects/Keywords: Gaussian wave packets; Mixed quantum/semiclassical dynamics; Optical spectroscopy signals

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APA (6th Edition):

Kovac, P. (2018). Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering. (Thesis). University of Oregon. Retrieved from http://hdl.handle.net/1794/23124

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):

Kovac, Philip. “Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering.” 2018. Thesis, University of Oregon. Accessed October 18, 2019. http://hdl.handle.net/1794/23124.

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

MLA Handbook (7th Edition):

Kovac, Philip. “Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering.” 2018. Web. 18 Oct 2019.

Vancouver:

Kovac P. Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering. [Internet] [Thesis]. University of Oregon; 2018. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/1794/23124.

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

Council of Science Editors:

Kovac P. Exploring time-dependent approaches towards the calculation of dynamics and spectroscopic signals: A mixed quantum/semiclassical wave packet method and the theory of transient absorption and femtosecond stimulated Raman scattering. [Thesis]. University of Oregon; 2018. Available from: http://hdl.handle.net/1794/23124

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


University of Texas – Austin

4. Xiong, Bangguo. Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach.

Degree: PhD, Physics, 2019, University of Texas – Austin

 This dissertation presents theoretical studies of the magnetization dynamics in ferromagnetic materials. To give a general description of the influences of electric fields or currents… (more)

Subjects/Keywords: Magnetization dynamics; Spin-orbital torques; Spin-transfer torques; Semiclassical theory

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APA (6th Edition):

Xiong, B. (2019). Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach. (Doctoral Dissertation). University of Texas – Austin. Retrieved from http://dx.doi.org/10.26153/tsw/2270

Chicago Manual of Style (16th Edition):

Xiong, Bangguo. “Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach.” 2019. Doctoral Dissertation, University of Texas – Austin. Accessed October 18, 2019. http://dx.doi.org/10.26153/tsw/2270.

MLA Handbook (7th Edition):

Xiong, Bangguo. “Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach.” 2019. Web. 18 Oct 2019.

Vancouver:

Xiong B. Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach. [Internet] [Doctoral dissertation]. University of Texas – Austin; 2019. [cited 2019 Oct 18]. Available from: http://dx.doi.org/10.26153/tsw/2270.

Council of Science Editors:

Xiong B. Toward a geometric theory of magnetization dynamics : electronic contribution in the semiclassical approach. [Doctoral Dissertation]. University of Texas – Austin; 2019. Available from: http://dx.doi.org/10.26153/tsw/2270


University of Alberta

5. Wong, Stephanie Y Y. Ab initio Semiclassical Initial Value Representation: Development of New Methods.

Degree: PhD, Department of Chemistry, 2013, University of Alberta

 Between the world of classical and quantum mechanics there lies a region where both are used to provide an accurate (quantum) but computationally tractable (classical)… (more)

Subjects/Keywords: ab initio; molecular dynamics; quantum dynamics; SC-IVR; photochemistry; vibrational states; electronic structure; vibrational energies; semiclassical initial value representation; classical mechanics; direct dynamics; semiclassical dynamics

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APA (6th Edition):

Wong, S. Y. Y. (2013). Ab initio Semiclassical Initial Value Representation: Development of New Methods. (Doctoral Dissertation). University of Alberta. Retrieved from https://era.library.ualberta.ca/files/3484zk780

Chicago Manual of Style (16th Edition):

Wong, Stephanie Y Y. “Ab initio Semiclassical Initial Value Representation: Development of New Methods.” 2013. Doctoral Dissertation, University of Alberta. Accessed October 18, 2019. https://era.library.ualberta.ca/files/3484zk780.

MLA Handbook (7th Edition):

Wong, Stephanie Y Y. “Ab initio Semiclassical Initial Value Representation: Development of New Methods.” 2013. Web. 18 Oct 2019.

Vancouver:

Wong SYY. Ab initio Semiclassical Initial Value Representation: Development of New Methods. [Internet] [Doctoral dissertation]. University of Alberta; 2013. [cited 2019 Oct 18]. Available from: https://era.library.ualberta.ca/files/3484zk780.

Council of Science Editors:

Wong SYY. Ab initio Semiclassical Initial Value Representation: Development of New Methods. [Doctoral Dissertation]. University of Alberta; 2013. Available from: https://era.library.ualberta.ca/files/3484zk780


University of Illinois – Urbana-Champaign

6. Chen, Jonathan E. Theoretical methods for the study of quantum dynamics.

Degree: PhD, 0337, 2010, University of Illinois – Urbana-Champaign

 Several theoretical methods for the computation of quantum dynamical quantities are formulated, implemented, and applied, in the overall context of overcoming the exponential scaling property… (more)

Subjects/Keywords: quantum dynamics; correlation functions; semiclassical approximation; quantum trajectories; Bohmian trajectories; Monte Carlo; forward-backward semiclassical dynamics; forward-backward quantum dynamics; sign problem; Hamilton's law of varying action

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APA (6th Edition):

Chen, J. E. (2010). Theoretical methods for the study of quantum dynamics. (Doctoral Dissertation). University of Illinois – Urbana-Champaign. Retrieved from http://hdl.handle.net/2142/16094

Chicago Manual of Style (16th Edition):

Chen, Jonathan E. “Theoretical methods for the study of quantum dynamics.” 2010. Doctoral Dissertation, University of Illinois – Urbana-Champaign. Accessed October 18, 2019. http://hdl.handle.net/2142/16094.

MLA Handbook (7th Edition):

Chen, Jonathan E. “Theoretical methods for the study of quantum dynamics.” 2010. Web. 18 Oct 2019.

Vancouver:

Chen JE. Theoretical methods for the study of quantum dynamics. [Internet] [Doctoral dissertation]. University of Illinois – Urbana-Champaign; 2010. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/2142/16094.

Council of Science Editors:

Chen JE. Theoretical methods for the study of quantum dynamics. [Doctoral Dissertation]. University of Illinois – Urbana-Champaign; 2010. Available from: http://hdl.handle.net/2142/16094

7. G. DI LIBERTO. NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY.

Degree: 2019, Università degli Studi di Milano

 The main goal of this doctoral work was to develop theoretical advances of the semiclassical theory applied to molecular spectroscopy. In particular, the attention was… (more)

Subjects/Keywords: Semiclassical; Vibrational Spectroscopy; Divide and Conquer; Molecular dynamics; Settore CHIM/02 - Chimica Fisica

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APA (6th Edition):

LIBERTO, G. D. (2019). NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY. (Thesis). Università degli Studi di Milano. Retrieved from http://hdl.handle.net/2434/612134

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):

LIBERTO, G. DI. “NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY.” 2019. Thesis, Università degli Studi di Milano. Accessed October 18, 2019. http://hdl.handle.net/2434/612134.

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

MLA Handbook (7th Edition):

LIBERTO, G. DI. “NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY.” 2019. Web. 18 Oct 2019.

Vancouver:

LIBERTO GD. NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY. [Internet] [Thesis]. Università degli Studi di Milano; 2019. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/2434/612134.

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

Council of Science Editors:

LIBERTO GD. NEW SEMICLASSICAL THEORIES FOR VIBRATIONAL SPECTROSCOPY. [Thesis]. Università degli Studi di Milano; 2019. Available from: http://hdl.handle.net/2434/612134

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


EPFL

8. Wehrle, Marius. Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics.

Degree: 2015, EPFL

 Linear and nonlinear spectroscopy techniques are widely used to study numerous important chemical and physical processes. However, the interpretation of these experimental spectra often becomes… (more)

Subjects/Keywords: on-the-fly ab initio semiclassical dynamics; accelerating quantum dynamics; split-operator method; linear spectroscopy; oligothiophene; ammonia; thawed Gaussian approximation

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APA (6th Edition):

Wehrle, M. (2015). Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics. (Thesis). EPFL. Retrieved from http://infoscience.epfl.ch/record/212705

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):

Wehrle, Marius. “Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics.” 2015. Thesis, EPFL. Accessed October 18, 2019. http://infoscience.epfl.ch/record/212705.

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

MLA Handbook (7th Edition):

Wehrle, Marius. “Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics.” 2015. Web. 18 Oct 2019.

Vancouver:

Wehrle M. Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics. [Internet] [Thesis]. EPFL; 2015. [cited 2019 Oct 18]. Available from: http://infoscience.epfl.ch/record/212705.

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

Council of Science Editors:

Wehrle M. Evaluation and analysis of vibrationally resolved electronic spectra with ab initio semiclassical dynamics. [Thesis]. EPFL; 2015. Available from: http://infoscience.epfl.ch/record/212705

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

9. Ivanov, Misha Yu. Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations.

Degree: 2018, Institute of Physics Publishing

Subjects/Keywords: Attoseconds dynamics; Time-dependent WKB; Semiclassical; Autoionization; Química

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APA (6th Edition):

Ivanov, M. Y. (2018). Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations. (Thesis). Institute of Physics Publishing. Retrieved from http://hdl.handle.net/10486/676734

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):

Ivanov, Misha Yu. “Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations.” 2018. Thesis, Institute of Physics Publishing. Accessed October 18, 2019. http://hdl.handle.net/10486/676734.

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

MLA Handbook (7th Edition):

Ivanov, Misha Yu. “Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations.” 2018. Web. 18 Oct 2019.

Vancouver:

Ivanov MY. Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations. [Internet] [Thesis]. Institute of Physics Publishing; 2018. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/10486/676734.

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

Council of Science Editors:

Ivanov MY. Signatures of attosecond electronic-nuclear dynamics in the one-photon ionization of molecular hydrogen: analytical model versus ab initio calculations. [Thesis]. Institute of Physics Publishing; 2018. Available from: http://hdl.handle.net/10486/676734

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


Freie Universität Berlin

10. Petersen, Jens. Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen.

Degree: 2013, Freie Universität Berlin

 Im Rahmen dieser Dissertation wurde ein allgemeines Verfahren für die Simulation und Kontrolle der lasergetriebenen gekoppelten Kern- Elektronendynamik in komplexen molekularen Systemen entwickelt, das auf… (more)

Subjects/Keywords: Coherent Control; Ultrafast Spectroscopy; Molecular Dynamics; Femtochemistry; Complex Systems; Semiclassical Dynamics; 500 Naturwissenschaften und Mathematik::530 Physik; 500 Naturwissenschaften und Mathematik::540 Chemie

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APA (6th Edition):

Petersen, J. (2013). Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen. (Thesis). Freie Universität Berlin. Retrieved from http://dx.doi.org/10.17169/refubium-11831

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):

Petersen, Jens. “Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen.” 2013. Thesis, Freie Universität Berlin. Accessed October 18, 2019. http://dx.doi.org/10.17169/refubium-11831.

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

MLA Handbook (7th Edition):

Petersen, Jens. “Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen.” 2013. Web. 18 Oct 2019.

Vancouver:

Petersen J. Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen. [Internet] [Thesis]. Freie Universität Berlin; 2013. [cited 2019 Oct 18]. Available from: http://dx.doi.org/10.17169/refubium-11831.

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

Council of Science Editors:

Petersen J. Entwicklung gemischt quanten-klassischer Methoden für kohärente Kontrolle und ultraschnelle Spektroskopie in komplexen Systemen. [Thesis]. Freie Universität Berlin; 2013. Available from: http://dx.doi.org/10.17169/refubium-11831

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

11. Alemi, Mallory. The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions .

Degree: 2015, Cornell University

Subjects/Keywords: semiclassical dynamics; vibrational response function; two-dimensional infrared spectroscopy

…Correspondence between density operator time evolution in 2FDs and semiclassical paths… …dynamics of lipids,15 proteins,16–19 and liquid water,20–22 and population relaxation17 and… …electrostatic potential or derivatives of this potential. Molecular dynamics (MD)… …to these methods we develop a semiclassical approximation46–54 with a uniform theoretical… …approximately quasiperiodic56, 57 on the timescales of interest. Other semiclassical approximations to… 

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APA (6th Edition):

Alemi, M. (2015). The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions . (Thesis). Cornell University. Retrieved from http://hdl.handle.net/1813/40687

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):

Alemi, Mallory. “The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions .” 2015. Thesis, Cornell University. Accessed October 18, 2019. http://hdl.handle.net/1813/40687.

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

MLA Handbook (7th Edition):

Alemi, Mallory. “The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions .” 2015. Web. 18 Oct 2019.

Vancouver:

Alemi M. The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions . [Internet] [Thesis]. Cornell University; 2015. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/1813/40687.

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

Council of Science Editors:

Alemi M. The Optimized Mean-Trajectory Approximation Of Vibrational Response Functions . [Thesis]. Cornell University; 2015. Available from: http://hdl.handle.net/1813/40687

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


Cornell University

12. Noid, William. The (Semi-)Classical Vibrational Echo .

Degree: 2005, Cornell University

 The ultrafast vibrational echo experiment is one of a modern generation of nonlinear coherent optical spectroscopies probing the nuclear dynamics of condensed phases. The vibrational… (more)

Subjects/Keywords: semiclassical dynamics; Herman-Kluk; vibrational spectroscopy; classical nonlinear response; MbCO A states; proteins; vibrational echoes; exciton; classical dephasing; resonant coupling

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APA (6th Edition):

Noid, W. (2005). The (Semi-)Classical Vibrational Echo . (Thesis). Cornell University. Retrieved from http://hdl.handle.net/1813/1475

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):

Noid, William. “The (Semi-)Classical Vibrational Echo .” 2005. Thesis, Cornell University. Accessed October 18, 2019. http://hdl.handle.net/1813/1475.

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

MLA Handbook (7th Edition):

Noid, William. “The (Semi-)Classical Vibrational Echo .” 2005. Web. 18 Oct 2019.

Vancouver:

Noid W. The (Semi-)Classical Vibrational Echo . [Internet] [Thesis]. Cornell University; 2005. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/1813/1475.

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

Council of Science Editors:

Noid W. The (Semi-)Classical Vibrational Echo . [Thesis]. Cornell University; 2005. Available from: http://hdl.handle.net/1813/1475

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

13. Iouchtchenko, Dmitri. Variations on PIGS: Non-standard approaches for imaginary-time path integrals.

Degree: 2015, University of Waterloo

 The second Rényi entropy has been used as a measure of entanglement in various model systems, including those on a lattice and in the continuum.… (more)

Subjects/Keywords: path integral; path integral ground state; molecular cluster; entanglement; entanglement entropy; Rényi entropy; quantum dynamics; semiclassical; Herman-Kluk

…Monte Carlo PIMD Path Integral Molecular Dynamics SC-IVR Semiclassical Initial Value… …9 . 11 . 15 . 17 . 18 . 21 . 21 . 28 3 Semiclassical IVR with PIGS 3.1 Numerical… …Molecular Dynamics (PIMD) [Tuc10, pp. 471,479].‡ In order to use these methods… …use of a transformation to normal modes and a Langevin dynamics thermostat [CPM10]… …dynamics equations of motion, derive the LePIGS algorithm. Solution on page 109. Using LePIGS, we… 

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APA (6th Edition):

Iouchtchenko, D. (2015). Variations on PIGS: Non-standard approaches for imaginary-time path integrals. (Thesis). University of Waterloo. Retrieved from http://hdl.handle.net/10012/9559

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):

Iouchtchenko, Dmitri. “Variations on PIGS: Non-standard approaches for imaginary-time path integrals.” 2015. Thesis, University of Waterloo. Accessed October 18, 2019. http://hdl.handle.net/10012/9559.

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

MLA Handbook (7th Edition):

Iouchtchenko, Dmitri. “Variations on PIGS: Non-standard approaches for imaginary-time path integrals.” 2015. Web. 18 Oct 2019.

Vancouver:

Iouchtchenko D. Variations on PIGS: Non-standard approaches for imaginary-time path integrals. [Internet] [Thesis]. University of Waterloo; 2015. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/10012/9559.

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

Council of Science Editors:

Iouchtchenko D. Variations on PIGS: Non-standard approaches for imaginary-time path integrals. [Thesis]. University of Waterloo; 2015. Available from: http://hdl.handle.net/10012/9559

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

14. ΦΑΡΑΝΤΟΣ, ΣΤΑΥΡΟΣ. ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ.

Degree: 1979, Institutes outside Greece; Ιδρύματα Εξωτερικού

THE THEME OF THIS THESIS IS THE CONSTRUCTION OF ANALYTICAL POTENTIAL ENERGY SURFACES FOR SMALL POLYATOMIC MOLECULES AND THE STUDY OF CERTAIN CHLORINE OXYGEN REACTIONS… (more)

Subjects/Keywords: ΔΥΝΑΜΙΚΗ ΕΝΕΡΓΕΙΑΚΗ ΕΠΙΦΑΝΕΙΑ; ΕΝΔΟΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ; ΗΛΕΚΤΡΟΝΙΑΚΗ ΔΟΜΗ ΜΟΡΙΩΝ; ΗΜΙΚΛΑΣΣΙΚΗ ΜΗΧΑΝΙΚΗ; ΚΛΑΣΣΙΚΕΣ ΤΡΟΧΙΕΣ; ΚΡΟΥΣΕΙΣ ΜΟΡΙΩΝ; CLASSICAL TRAJECTORIES; INTRAMOLECULAR DYNAMICS; MOLECULAR COLLISIONS; MOLECULAR ELECTRONIC STRUCTURE; POTENTIAL ENERGY SURFACE; SEMICLASSICAL MECHANICS

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

APA (6th Edition):

ΦΑΡΑΝΤΟΣ, . . (1979). ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ. (Thesis). Institutes outside Greece; Ιδρύματα Εξωτερικού. Retrieved from http://hdl.handle.net/10442/hedi/0842

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):

ΦΑΡΑΝΤΟΣ, ΣΤΑΥΡΟΣ. “ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ.” 1979. Thesis, Institutes outside Greece; Ιδρύματα Εξωτερικού. Accessed October 18, 2019. http://hdl.handle.net/10442/hedi/0842.

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

MLA Handbook (7th Edition):

ΦΑΡΑΝΤΟΣ, ΣΤΑΥΡΟΣ. “ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ.” 1979. Web. 18 Oct 2019.

Vancouver:

ΦΑΡΑΝΤΟΣ . ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ. [Internet] [Thesis]. Institutes outside Greece; Ιδρύματα Εξωτερικού; 1979. [cited 2019 Oct 18]. Available from: http://hdl.handle.net/10442/hedi/0842.

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

Council of Science Editors:

ΦΑΡΑΝΤΟΣ . ΔΥΝΑΜΙΚΕΣ ΕΝΕΡΓΕΙΑΚΕΣ ΕΠΙΦΑΝΕΙΕΣ ΚΑΙ ΜΟΡΙΑΚΗ ΔΥΝΑΜΙΚΗ ΣΥΣΤΗΜΑΤΩΝ ΧΛΩΡΙΟΥ-ΟΞΥΓΟΝΟΥ. [Thesis]. Institutes outside Greece; Ιδρύματα Εξωτερικού; 1979. Available from: http://hdl.handle.net/10442/hedi/0842

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

15. Shim, Sangwoo. Quantum Dynamics in Biological Systems.

Degree: PhD, Chemical Physics, 2012, Harvard University

 In the first part of this dissertation, recent efforts to understand quantum mechanical effects in biological systems are discussed. Especially, long-lived quantum coherences observed during… (more)

Subjects/Keywords: Fenna-Matthews-Olson complex; long-lived quantum coherences; molecular dynamics; path integral Monte Carlo; resonance Raman; semiclassical initial value representation; chemistry; molecular physics; quantum physics

…J. 102, 649 (2012). “First-principles semiclassical initial value representation… …molecular dynamics,” Michele Ceotto, Sule Atahan, Sangwoo Shim, Gian Franco Tantardini and Al´an… …University, for introducing me to Monte Carlo and molecular dynamics simulations. These techniques… …for quantum dynamics and their associated chemical phenomena. The cost of solving the time… …quantum mechanical dynamics easily becomes untractable with currently available computational… 

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

APA (6th Edition):

Shim, S. (2012). Quantum Dynamics in Biological Systems. (Doctoral Dissertation). Harvard University. Retrieved from http://nrs.harvard.edu/urn-3:HUL.InstRepos:10058477

Chicago Manual of Style (16th Edition):

Shim, Sangwoo. “Quantum Dynamics in Biological Systems.” 2012. Doctoral Dissertation, Harvard University. Accessed October 18, 2019. http://nrs.harvard.edu/urn-3:HUL.InstRepos:10058477.

MLA Handbook (7th Edition):

Shim, Sangwoo. “Quantum Dynamics in Biological Systems.” 2012. Web. 18 Oct 2019.

Vancouver:

Shim S. Quantum Dynamics in Biological Systems. [Internet] [Doctoral dissertation]. Harvard University; 2012. [cited 2019 Oct 18]. Available from: http://nrs.harvard.edu/urn-3:HUL.InstRepos:10058477.

Council of Science Editors:

Shim S. Quantum Dynamics in Biological Systems. [Doctoral Dissertation]. Harvard University; 2012. Available from: http://nrs.harvard.edu/urn-3:HUL.InstRepos:10058477


University of Oxford

16. Rodgers, Christopher T. Magnetic field effects in chemical systems.

Degree: PhD, 2007, University of Oxford

 Magnetic fields influence the rate and/or yield of chemical reactions that proceed via spin correlated radical pair intermediates. The field of spin chemistry centres around… (more)

Subjects/Keywords: 541.378; Molecular biophysics (biochemistry); Behaviour (zoology); Physical Sciences; Chemistry & allied sciences; Biophysical chemistry; NMR spectroscopy; Photochemistry and reaction dynamics; Physical & theoretical chemistry; Spectroscopy and molecular structure; Theoretical chemistry; Biophysics; magnetic; magnetic field effect; MARY-nu; polarization; Tikhonov; Maximum Entropy; regularization; semiclassical; zero-field EPR; electron spin resonance; electron paramagnetic resonance; magnetoreception; Erithacus rubecula; Ritz; Wiltschko; anisotropic

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

APA (6th Edition):

Rodgers, C. T. (2007). Magnetic field effects in chemical systems. (Doctoral Dissertation). University of Oxford. Retrieved from http://ora.ox.ac.uk/objects/uuid:f5878b88-c5ba-4cbd-83af-857431aef66e ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.442570

Chicago Manual of Style (16th Edition):

Rodgers, Christopher T. “Magnetic field effects in chemical systems.” 2007. Doctoral Dissertation, University of Oxford. Accessed October 18, 2019. http://ora.ox.ac.uk/objects/uuid:f5878b88-c5ba-4cbd-83af-857431aef66e ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.442570.

MLA Handbook (7th Edition):

Rodgers, Christopher T. “Magnetic field effects in chemical systems.” 2007. Web. 18 Oct 2019.

Vancouver:

Rodgers CT. Magnetic field effects in chemical systems. [Internet] [Doctoral dissertation]. University of Oxford; 2007. [cited 2019 Oct 18]. Available from: http://ora.ox.ac.uk/objects/uuid:f5878b88-c5ba-4cbd-83af-857431aef66e ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.442570.

Council of Science Editors:

Rodgers CT. Magnetic field effects in chemical systems. [Doctoral Dissertation]. University of Oxford; 2007. Available from: http://ora.ox.ac.uk/objects/uuid:f5878b88-c5ba-4cbd-83af-857431aef66e ; https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.442570

.