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Physical Chemistry Chemical Physics : PCCP
|
May 7, 2010
Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations
David Asturiol, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Physical Chemistry. A
|
December 15, 2006
Photostability via sloped conical intersections: a computational study of the excited states of the naphthalene radical cation
Katherine F Hall, 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.
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.
Molecules (Basel, Switzerland)
|
November 17, 2007
A first-principles analysis of the magnetism of CuII polynuclear coordination complexes: the case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4.2.5H2O
Mercè Deumal, Jordi Ribas-Ariño, Michael A Robb, et al.
Journal of the American Chemical Society
|
August 19, 2007
Ultrafast deactivation channel for thymine dimerization
Martial Boggio-Pasqua, Gerrit Groenhof, Lars V Schäfer, 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.
Plos Computational Biology
|
March 29, 2008
Chromophore protonation state controls photoswitching of the fluoroprotein asFP595
Lars V Schäfer, Gerrit Groenhof, Martial Boggio-Pasqua, et al.
Journal of the American Chemical Society
|
February 26, 2008
Arginine52 controls the photoisomerization process in photoactive yellow protein
Gerrit Groenhof, Lars V Schäfer, Martial Boggio-Pasqua, et al.
The Journal of Organic Chemistry
|
April 4, 1997
MCSCF/MP2 Study of the Cheletropic Addition of Singlet and Triplet CF(2) and C(OH)(2) to the Ethene Double Bond
Fernando Bernardi, Andrea Bottoni, Carlo Canepa, et al.
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of 9
Search research articles
Search
Showing results (51-60 of 88) with videos related to
Sort By:
Page
of 9
Physical Chemistry Chemical Physics : PCCP
|
May 7, 2010
Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations
David Asturiol, Benjamin Lasorne, Graham A Worth, et al.
The Journal of Physical Chemistry. A
|
December 15, 2006
Photostability via sloped conical intersections: a computational study of the excited states of the naphthalene radical cation
Katherine F Hall, 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.
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.
Molecules (Basel, Switzerland)
|
November 17, 2007
A first-principles analysis of the magnetism of CuII polynuclear coordination complexes: the case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4.2.5H2O
Mercè Deumal, Jordi Ribas-Ariño, Michael A Robb, et al.
Journal of the American Chemical Society
|
August 19, 2007
Ultrafast deactivation channel for thymine dimerization
Martial Boggio-Pasqua, Gerrit Groenhof, Lars V Schäfer, 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.
Plos Computational Biology
|
March 29, 2008
Chromophore protonation state controls photoswitching of the fluoroprotein asFP595
Lars V Schäfer, Gerrit Groenhof, Martial Boggio-Pasqua, et al.
Journal of the American Chemical Society
|
February 26, 2008
Arginine52 controls the photoisomerization process in photoactive yellow protein
Gerrit Groenhof, Lars V Schäfer, Martial Boggio-Pasqua, et al.
The Journal of Organic Chemistry
|
April 4, 1997
MCSCF/MP2 Study of the Cheletropic Addition of Singlet and Triplet CF(2) and C(OH)(2) to the Ethene Double Bond
Fernando Bernardi, Andrea Bottoni, Carlo Canepa, et al.
Page
of 9