Quantum Chemistry and Dynamics of Excited States
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9781119417750, 9781119417774
Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Ehrenfest Methods for Electron and Nuclear Dynamics

2020 ◽  
pp. 469-497
Author(s):  
Adam Kirrander ◽  
Morgane Vacher
Keyword(s):  
Nuclear Dynamics

Multi‐Reference Configuration Interaction

2020 ◽  
pp. 277-297
Author(s):  
Felix Plasser ◽  
Hans Lischka
Keyword(s):  
Configuration Interaction ◽  
Reference Configuration

Equation‐of‐Motion Coupled‐Cluster Models

2020 ◽  
pp. 77-108
Author(s):  
Monika Musiał
Keyword(s):  
Equation Of Motion ◽  
Cluster Models ◽  
Coupled Cluster

Surface Hopping Molecular Dynamics

2020 ◽  
pp. 499-530
Author(s):  
Sebastian Mai ◽  
Philipp Marquetand ◽  
Leticia González
Keyword(s):  
Molecular Dynamics ◽  
Surface Hopping

Semiclassical Molecular Dynamics for Spectroscopic Calculations

2020 ◽  
pp. 595-628
Author(s):  
Riccardo Conte ◽  
Michele Ceotto
Keyword(s):  
Molecular Dynamics

Time‐Dependent Density Functional Theory

2020 ◽  
pp. 13-46
Author(s):  
Miquel Huix‐Rotllant ◽  
Nicolas Ferré ◽  
Mario Barbatti
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Time Dependent ◽  
Functional Theory ◽  
Dependent Density

Multi‐Configurational Reference Perturbation Theory with a CASSCF Reference Function

2020 ◽  
pp. 299-353
Author(s):  
Roland Lindh ◽  
Ignacio Fdez. Galván
Keyword(s):  
Perturbation Theory ◽  
Reference Function

scholarly journals Excited‐State Calculations with Quantum Monte Carlo

2020 ◽  
pp. 247-275
Author(s):  
Jonas Feldt ◽  
Claudia Filippi
Keyword(s):  
Monte Carlo ◽  
Excited State ◽  
Quantum Monte Carlo
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