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The Journal of Physical Chemistry. A
|
October 4, 2008
Photostability via sloped conical intersections: a computational study of the pyrene radical cation
Andrei M Tokmachev, Martial Boggio-Pasqua, Michael J Bearpark, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 9, 2004
The mechanism of magnetic interactions in the bulk ferromagnet para-(methylthio)phenyl nitronyl nitroxide (YUJNEW): a first principles, bottom-up, theoretical study
Mercè Deumal, Michael J Bearpark, Michael A Robb, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Deconstructing the ONIOM Hessian: Investigating Method Combinations for Transition Structures
Thom Vreven, Lee M Thompson, Susan M Larkin, et al.
The Journal of Physical Chemistry. A
|
December 4, 2014
Electronic control of initial nuclear dynamics adjacent to a conical intersection
Morgane Vacher, Jan Meisner, David Mendive-Tapia, et al.
The Journal of Chemical Physics
|
March 16, 2015
Minimising biases in full configuration interaction quantum Monte Carlo
W A Vigor, J S Spencer, M J Bearpark, et al.
The Journal of Chemical Physics
|
March 10, 2016
Understanding and improving the efficiency of full configuration interaction quantum Monte Carlo
W A Vigor, J S Spencer, M J Bearpark, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 18, 2010
Controlling the mechanism of fulvene S(1)/S(0) decay: switching off the stepwise population transfer
David Mendive-Tapia, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Physical Chemistry. A
|
October 29, 2010
Controlling product selection in the photodissociation of formaldehyde: direct quantum dynamics from the S1 barrier
Marta Araújo, Benjamin Lasorne, Alexandre L Magalhães, et al.
The Journal of Chemical Physics
|
December 20, 2012
Towards converging non-adiabatic direct dynamics calculations using frozen-width variational gaussian product basis functions
David Mendive-Tapia, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Chemical Physics
|
November 3, 2016
Charge migration in polycyclic norbornadiene cations: Winning the race against decoherence
Andrew J Jenkins, Morgane Vacher, Rebecca M Twidale, et al.
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of 8
Search research articles
Search
Showing results (41-50 of 72) with videos related to
Sort By:
Page
of 8
The Journal of Physical Chemistry. A
|
October 4, 2008
Photostability via sloped conical intersections: a computational study of the pyrene radical cation
Andrei M Tokmachev, Martial Boggio-Pasqua, Michael J Bearpark, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 9, 2004
The mechanism of magnetic interactions in the bulk ferromagnet para-(methylthio)phenyl nitronyl nitroxide (YUJNEW): a first principles, bottom-up, theoretical study
Mercè Deumal, Michael J Bearpark, Michael A Robb, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Deconstructing the ONIOM Hessian: Investigating Method Combinations for Transition Structures
Thom Vreven, Lee M Thompson, Susan M Larkin, et al.
The Journal of Physical Chemistry. A
|
December 4, 2014
Electronic control of initial nuclear dynamics adjacent to a conical intersection
Morgane Vacher, Jan Meisner, David Mendive-Tapia, et al.
The Journal of Chemical Physics
|
March 16, 2015
Minimising biases in full configuration interaction quantum Monte Carlo
W A Vigor, J S Spencer, M J Bearpark, et al.
The Journal of Chemical Physics
|
March 10, 2016
Understanding and improving the efficiency of full configuration interaction quantum Monte Carlo
W A Vigor, J S Spencer, M J Bearpark, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 18, 2010
Controlling the mechanism of fulvene S(1)/S(0) decay: switching off the stepwise population transfer
David Mendive-Tapia, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Physical Chemistry. A
|
October 29, 2010
Controlling product selection in the photodissociation of formaldehyde: direct quantum dynamics from the S1 barrier
Marta Araújo, Benjamin Lasorne, Alexandre L Magalhães, et al.
The Journal of Chemical Physics
|
December 20, 2012
Towards converging non-adiabatic direct dynamics calculations using frozen-width variational gaussian product basis functions
David Mendive-Tapia, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Chemical Physics
|
November 3, 2016
Charge migration in polycyclic norbornadiene cations: Winning the race against decoherence
Andrew J Jenkins, Morgane Vacher, Rebecca M Twidale, et al.
Page
of 8