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The Journal of Chemical Physics
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May 17, 2013
On trajectory-based nonadiabatic dynamics: Bohmian dynamics versus trajectory surface hopping
Basile F E Curchod, Ivano Tavernelli
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences
|
March 28, 2022
Chemistry without the Born-Oppenheimer approximation
Federica Agostini, Basile F E Curchod
The Journal of Chemical Physics
|
November 7, 2021
Dynamics near a conical intersection-A diabolical compromise for the approximations of ab initio multiple spawning
Lea M Ibele, Basile F E Curchod
Inorganic Chemistry
|
August 23, 2011
The cause for tremendous acceleration of chloride substitution via base catalysis in the chloro pentaammine cobalt(III) ion
Basile F E Curchod, François P Rotzinger
Chemical Reviews
|
February 22, 2018
Ab Initio Nonadiabatic Quantum Molecular Dynamics
Basile F E Curchod, Todd J Martínez
Physical Chemistry Chemical Physics : PCCP
|
June 26, 2020
A molecular perspective on Tully models for nonadiabatic dynamics
Lea M Ibele, Basile F E Curchod
Chemical Communications (Cambridge, England)
|
October 17, 2025
Spectroscopic characterisation of metastable photoswitches for CO<sub>2</sub> capture and release
Federico J Hernández, Basile F E Curchod
The Journal of Physical Chemistry. A
|
December 4, 2024
Exploring the Influence of Approximations for Simulating Valence Excited X-ray Spectra
Thomas J Penfold, Basile F E Curchod
Accounts of Chemical Research
|
January 9, 2025
Selecting Initial Conditions for Trajectory-Based Nonadiabatic Simulations
Jiří Janoš, Petr Slavíček, Basile F E Curchod
The Journal of Physical Chemistry Letters
|
December 21, 2022
Extending the Applicability of the Multiple-Spawning Framework for Nonadiabatic Molecular Dynamics
Yorick Lassmann, Daniel Hollas, Basile F E Curchod
Page
of 10
Search research articles
Search
Showing results (11-20 of 99) with videos related to
Sort By:
Page
of 10
The Journal of Chemical Physics
|
May 17, 2013
On trajectory-based nonadiabatic dynamics: Bohmian dynamics versus trajectory surface hopping
Basile F E Curchod, Ivano Tavernelli
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences
|
March 28, 2022
Chemistry without the Born-Oppenheimer approximation
Federica Agostini, Basile F E Curchod
The Journal of Chemical Physics
|
November 7, 2021
Dynamics near a conical intersection-A diabolical compromise for the approximations of ab initio multiple spawning
Lea M Ibele, Basile F E Curchod
Inorganic Chemistry
|
August 23, 2011
The cause for tremendous acceleration of chloride substitution via base catalysis in the chloro pentaammine cobalt(III) ion
Basile F E Curchod, François P Rotzinger
Chemical Reviews
|
February 22, 2018
Ab Initio Nonadiabatic Quantum Molecular Dynamics
Basile F E Curchod, Todd J Martínez
Physical Chemistry Chemical Physics : PCCP
|
June 26, 2020
A molecular perspective on Tully models for nonadiabatic dynamics
Lea M Ibele, Basile F E Curchod
Chemical Communications (Cambridge, England)
|
October 17, 2025
Spectroscopic characterisation of metastable photoswitches for CO<sub>2</sub> capture and release
Federico J Hernández, Basile F E Curchod
The Journal of Physical Chemistry. A
|
December 4, 2024
Exploring the Influence of Approximations for Simulating Valence Excited X-ray Spectra
Thomas J Penfold, Basile F E Curchod
Accounts of Chemical Research
|
January 9, 2025
Selecting Initial Conditions for Trajectory-Based Nonadiabatic Simulations
Jiří Janoš, Petr Slavíček, Basile F E Curchod
The Journal of Physical Chemistry Letters
|
December 21, 2022
Extending the Applicability of the Multiple-Spawning Framework for Nonadiabatic Molecular Dynamics
Yorick Lassmann, Daniel Hollas, Basile F E Curchod
Page
of 10