Search research articles
Contact Us
Filters
Showing results (11-20 of 46) with videos related to
Page
of 5
Sort By:
Journal of Chemical Theory and Computation
|
November 18, 2015
Peak-shifting in real-time time-dependent density functional theory
Makenzie R Provorse, Bradley F Habenicht, Christine M Isborn
The Journal of Physical Chemistry. A
|
June 2, 2006
Ab initio diradical/zwitterionic polarizabilities and hyperpolarizabilities in twisted double bonds
Christine M Isborn, Ernest R Davidson, Bruce H Robinson
The Journal of Physical Chemistry. B
|
December 28, 2019
Influence of Electronic Polarization on the Spectral Density
Tim J Zuehlsdorff, Hanbo Hong, Liang Shi, et al.
The Journal of Physical Chemistry. B
|
November 1, 2016
Convergence of Excitation Energies in Mixed Quantum and Classical Solvent: Comparison of Continuum and Point Charge Models
Makenzie R Provorse, Thomas Peev, Chou Xiong, et al.
The Journal of Chemical Physics
|
August 6, 2020
Nonlinear spectroscopy in the condensed phase: The role of Duschinsky rotations and third order cumulant contributions
Tim J Zuehlsdorff, Hanbo Hong, Liang Shi, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 29, 2020
Molecular dynamics simulations of alkaline earth metal ions binding to DNA reveal ion size and hydration effects
Makenzie Provorse Long, Serra Alland, Madison E Martin, et al.
The Journal of Chemical Physics
|
February 12, 2009
Representation independent algorithms for molecular response calculations in time-dependent self-consistent field theories
Sergei Tretiak, Christine M Isborn, Anders M N Niklasson, et al.
The Journal of Chemical Physics
|
July 30, 2024
Calculating absorption and fluorescence spectra for chromophores in solution with ensemble Franck-Condon methods
Ajay Khanna, Sapana V Shedge, Tim J Zuehlsdorff, et al.
The Journal of Chemical Physics
|
April 1, 2026
Efficient simulation of optical spectra via machine learning and physical decomposition of environmental effects
Andrew Snider, Michael S Chen, Thomas E Markland, et al.
Organic Letters
|
October 7, 2008
Internal dynamics and optical rotations predicted for O(h)- and O-symmetric cubanes
David A Hrovat, Christine M Isborn, Bart Kahr, et al.
Page
of 5
Search research articles
Search
Showing results (11-20 of 46) with videos related to
Sort By:
Page
of 5
Journal of Chemical Theory and Computation
|
November 18, 2015
Peak-shifting in real-time time-dependent density functional theory
Makenzie R Provorse, Bradley F Habenicht, Christine M Isborn
The Journal of Physical Chemistry. A
|
June 2, 2006
Ab initio diradical/zwitterionic polarizabilities and hyperpolarizabilities in twisted double bonds
Christine M Isborn, Ernest R Davidson, Bruce H Robinson
The Journal of Physical Chemistry. B
|
December 28, 2019
Influence of Electronic Polarization on the Spectral Density
Tim J Zuehlsdorff, Hanbo Hong, Liang Shi, et al.
The Journal of Physical Chemistry. B
|
November 1, 2016
Convergence of Excitation Energies in Mixed Quantum and Classical Solvent: Comparison of Continuum and Point Charge Models
Makenzie R Provorse, Thomas Peev, Chou Xiong, et al.
The Journal of Chemical Physics
|
August 6, 2020
Nonlinear spectroscopy in the condensed phase: The role of Duschinsky rotations and third order cumulant contributions
Tim J Zuehlsdorff, Hanbo Hong, Liang Shi, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 29, 2020
Molecular dynamics simulations of alkaline earth metal ions binding to DNA reveal ion size and hydration effects
Makenzie Provorse Long, Serra Alland, Madison E Martin, et al.
The Journal of Chemical Physics
|
February 12, 2009
Representation independent algorithms for molecular response calculations in time-dependent self-consistent field theories
Sergei Tretiak, Christine M Isborn, Anders M N Niklasson, et al.
The Journal of Chemical Physics
|
July 30, 2024
Calculating absorption and fluorescence spectra for chromophores in solution with ensemble Franck-Condon methods
Ajay Khanna, Sapana V Shedge, Tim J Zuehlsdorff, et al.
The Journal of Chemical Physics
|
April 1, 2026
Efficient simulation of optical spectra via machine learning and physical decomposition of environmental effects
Andrew Snider, Michael S Chen, Thomas E Markland, et al.
Organic Letters
|
October 7, 2008
Internal dynamics and optical rotations predicted for O(h)- and O-symmetric cubanes
David A Hrovat, Christine M Isborn, Bart Kahr, et al.
Page
of 5