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The Journal of Chemical Physics
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October 24, 2014
Calculating time-resolved differential absorbance spectra for ultrafast pump-probe experiments with surface hopping trajectories
Andrew S Petit, Joseph E Subotnik
The Journal of Physical Chemistry Letters
|
May 29, 2019
The Simplest Possible Approach for Simulating S<sub>0</sub>- S<sub>1</sub> Conical Intersections with DFT/TDDFT: Adding One Doubly Excited Configuration
Hung-Hsuan Teh, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
November 18, 2015
Appraisal of Surface Hopping as a Tool for Modeling Condensed Phase Linear Absorption Spectra
Andrew S Petit, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
November 21, 2015
Quantifying the Lifetime of Triplet Energy Transfer Processes in Organic Chromophores: A Case Study of 4-(2-Naphthylmethyl)benzaldehyde
Brian R Landry, Joseph E Subotnik
The Journal of Chemical Physics
|
August 27, 2005
A local correlation model that yields intrinsically smooth potential-energy surfaces
Joseph E Subotnik, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
January 31, 2015
On surface hopping and time-reversal
Joseph E Subotnik, Young Min Rhee
The Journal of Chemical Physics
|
March 3, 2005
A localized basis that allows fast and accurate second-order Moller-Plesset calculations
Joseph E Subotnik, Martin Head-Gordon
The Journal of Physical Chemistry Letters
|
January 18, 2023
Symmetric Post-Transition State Bifurcation Reactions with Berry Pseudomagnetic Fields
Zhen Tao, Tian Qiu, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
June 21, 2023
Correction to "A Practical Approach to Wave Function Propagation, Hopping Probabilities, and Time Steps in Surface Hopping Calculations"
Tian Qiu, Clàudia Climent, Joseph E Subotnik
The Journal of Chemical Physics
|
October 5, 2013
Derivative couplings and analytic gradients for diabatic states, with an implementation for Boys-localized configuration-interaction singles
Shervin Fatehi, Ethan Alguire, Joseph E Subotnik
Page
of 17
Search research articles
Search
Showing results (41-50 of 166) with videos related to
Sort By:
Page
of 17
The Journal of Chemical Physics
|
October 24, 2014
Calculating time-resolved differential absorbance spectra for ultrafast pump-probe experiments with surface hopping trajectories
Andrew S Petit, Joseph E Subotnik
The Journal of Physical Chemistry Letters
|
May 29, 2019
The Simplest Possible Approach for Simulating S<sub>0</sub>- S<sub>1</sub> Conical Intersections with DFT/TDDFT: Adding One Doubly Excited Configuration
Hung-Hsuan Teh, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
November 18, 2015
Appraisal of Surface Hopping as a Tool for Modeling Condensed Phase Linear Absorption Spectra
Andrew S Petit, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
November 21, 2015
Quantifying the Lifetime of Triplet Energy Transfer Processes in Organic Chromophores: A Case Study of 4-(2-Naphthylmethyl)benzaldehyde
Brian R Landry, Joseph E Subotnik
The Journal of Chemical Physics
|
August 27, 2005
A local correlation model that yields intrinsically smooth potential-energy surfaces
Joseph E Subotnik, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
January 31, 2015
On surface hopping and time-reversal
Joseph E Subotnik, Young Min Rhee
The Journal of Chemical Physics
|
March 3, 2005
A localized basis that allows fast and accurate second-order Moller-Plesset calculations
Joseph E Subotnik, Martin Head-Gordon
The Journal of Physical Chemistry Letters
|
January 18, 2023
Symmetric Post-Transition State Bifurcation Reactions with Berry Pseudomagnetic Fields
Zhen Tao, Tian Qiu, Joseph E Subotnik
Journal of Chemical Theory and Computation
|
June 21, 2023
Correction to "A Practical Approach to Wave Function Propagation, Hopping Probabilities, and Time Steps in Surface Hopping Calculations"
Tian Qiu, Clàudia Climent, Joseph E Subotnik
The Journal of Chemical Physics
|
October 5, 2013
Derivative couplings and analytic gradients for diabatic states, with an implementation for Boys-localized configuration-interaction singles
Shervin Fatehi, Ethan Alguire, Joseph E Subotnik
Page
of 17