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The Journal of Chemical Physics
|
May 3, 2019
Geodesic interpolation for reaction pathways
Xiaolei Zhu, Keiran C Thompson, Todd J Martínez
Journal of Chemical Theory and Computation
|
January 19, 2018
Large-Scale Functional Group Symmetry-Adapted Perturbation Theory on Graphical Processing Units
Robert M Parrish, Keiran C Thompson, Todd J Martínez
The Journal of Physical Chemistry. A
|
July 13, 2006
On the extent of intramolecular hydrogen bonding in gas-phase and hydrated 1,2-ethanediol
Deborah L Crittenden, Keiran C Thompson, Meredith J T Jordan
Journal of the American Chemical Society
|
March 31, 2005
CH5+: chemistry's chameleon unmasked
Keiran C Thompson, Deborah L Crittenden, Meredith J T Jordan
The Journal of Chemical Physics
|
November 20, 2004
Efficiency considerations in the construction of interpolated potential energy surfaces for the calculation of quantum observables by diffusion Monte Carlo
Deborah L Crittenden, Keiran C Thompson, Mary Chebib, et al.
The Journal of Chemical Physics
|
February 8, 2006
A classical trajectory study of the photodissociation of T1 acetaldehyde: the transition from impulsive to statistical dynamics
Keiran C Thompson, Deborah L Crittenden, Scott H Kable, et al.
Chemical Science
|
July 14, 2023
First principles reaction discovery: from the Schrodinger equation to experimental prediction for methane pyrolysis
Rui Xu, Jan Meisner, Alexander M Chang, et al.
Chemical Science
|
June 24, 2021
The non-adiabatic nanoreactor: towards the automated discovery of photochemistry
Elisa Pieri, Dean Lahana, Alexander M Chang, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
May 3, 2019
Geodesic interpolation for reaction pathways
Xiaolei Zhu, Keiran C Thompson, Todd J Martínez
Journal of Chemical Theory and Computation
|
January 19, 2018
Large-Scale Functional Group Symmetry-Adapted Perturbation Theory on Graphical Processing Units
Robert M Parrish, Keiran C Thompson, Todd J Martínez
The Journal of Physical Chemistry. A
|
July 13, 2006
On the extent of intramolecular hydrogen bonding in gas-phase and hydrated 1,2-ethanediol
Deborah L Crittenden, Keiran C Thompson, Meredith J T Jordan
Journal of the American Chemical Society
|
March 31, 2005
CH5+: chemistry's chameleon unmasked
Keiran C Thompson, Deborah L Crittenden, Meredith J T Jordan
The Journal of Chemical Physics
|
November 20, 2004
Efficiency considerations in the construction of interpolated potential energy surfaces for the calculation of quantum observables by diffusion Monte Carlo
Deborah L Crittenden, Keiran C Thompson, Mary Chebib, et al.
The Journal of Chemical Physics
|
February 8, 2006
A classical trajectory study of the photodissociation of T1 acetaldehyde: the transition from impulsive to statistical dynamics
Keiran C Thompson, Deborah L Crittenden, Scott H Kable, et al.
Chemical Science
|
July 14, 2023
First principles reaction discovery: from the Schrodinger equation to experimental prediction for methane pyrolysis
Rui Xu, Jan Meisner, Alexander M Chang, et al.
Chemical Science
|
June 24, 2021
The non-adiabatic nanoreactor: towards the automated discovery of photochemistry
Elisa Pieri, Dean Lahana, Alexander M Chang, et al.
Page
of 1