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Physical Chemistry Chemical Physics : PCCP
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September 4, 2008
Quantum algorithm for obtaining the energy spectrum of molecular systems
Hefeng Wang, Sabre Kais, Alán Aspuru-Guzik, et al.
Inorganic Chemistry
|
February 20, 2009
Influence of alkoxyl substituent on 4,6-diphenyl-2,2'-bipyridine ligand on photophysics of cyclometalated platinum(II) complexes: admixing intraligand charge transfer character in low-lying excited states
Pin Shao, Yunjing Li, Alexander Azenkeng, et al.
The Journal of Physical Chemistry. A
|
April 20, 2012
GVVPT2 multireference perturbation theory description of diatomic scandium, chromium, and manganese
Patrick K Tamukong, Daniel Theis, Yuriy G Khait, et al.
The Journal of Physical Chemistry. A
|
February 15, 2008
Generalized van Vleck perturbation theory (GVVPT2) study of the excited states of benzene and the azabenzenes
Ajitha Devarajan, Alexander V Gaenko, Yuri G Khait, et al.
The Journal of Physical Chemistry. A
|
July 15, 2006
Theoretical UV circular dichroism of aliphatic cyclic dipeptides
Kristine L Carlson, Stephen L Lowe, Mark R Hoffmann, et al.
The Journal of Physical Chemistry. A
|
February 3, 2006
Theoretical UV circular dichroism of cyclo(L-Proline-L-Proline)
Kristine L Carlson, Stephen L Lowe, Mark R Hoffmann, et al.
The Journal of Physical Chemistry. A
|
June 12, 2010
Multireference generalized Van Vleck perturbation theory (GVVPT2) study of the NCO + HCNO reaction: insight into intermediates
Yvonne E Bongfen Mbote, Yuriy G Khait, Cynthia Hardel, et al.
The Journal of Chemical Physics
|
April 20, 2005
Multireference configuration interaction based electronic Floquet states for molecules in an intense radiation field: theory and application to Li(2)+
Yuriy G Khait, Alexander Azenkeng, Hefeng Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 21, 2013
The dissociation of glycolate-astrochemical and prebiotic relevance
Anton Simakov, Glenn B S Miller, Arne J C Bunkan, et al.
The Journal of Chemical Physics
|
December 2, 2009
Comparative study of multireference perturbative theories for ground and excited states
Mark R Hoffmann, Dipayan Datta, Sanghamitra Das, et al.
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of 5
Search research articles
Search
Showing results (31-40 of 44) with videos related to
Sort By:
Page
of 5
Physical Chemistry Chemical Physics : PCCP
|
September 4, 2008
Quantum algorithm for obtaining the energy spectrum of molecular systems
Hefeng Wang, Sabre Kais, Alán Aspuru-Guzik, et al.
Inorganic Chemistry
|
February 20, 2009
Influence of alkoxyl substituent on 4,6-diphenyl-2,2'-bipyridine ligand on photophysics of cyclometalated platinum(II) complexes: admixing intraligand charge transfer character in low-lying excited states
Pin Shao, Yunjing Li, Alexander Azenkeng, et al.
The Journal of Physical Chemistry. A
|
April 20, 2012
GVVPT2 multireference perturbation theory description of diatomic scandium, chromium, and manganese
Patrick K Tamukong, Daniel Theis, Yuriy G Khait, et al.
The Journal of Physical Chemistry. A
|
February 15, 2008
Generalized van Vleck perturbation theory (GVVPT2) study of the excited states of benzene and the azabenzenes
Ajitha Devarajan, Alexander V Gaenko, Yuri G Khait, et al.
The Journal of Physical Chemistry. A
|
July 15, 2006
Theoretical UV circular dichroism of aliphatic cyclic dipeptides
Kristine L Carlson, Stephen L Lowe, Mark R Hoffmann, et al.
The Journal of Physical Chemistry. A
|
February 3, 2006
Theoretical UV circular dichroism of cyclo(L-Proline-L-Proline)
Kristine L Carlson, Stephen L Lowe, Mark R Hoffmann, et al.
The Journal of Physical Chemistry. A
|
June 12, 2010
Multireference generalized Van Vleck perturbation theory (GVVPT2) study of the NCO + HCNO reaction: insight into intermediates
Yvonne E Bongfen Mbote, Yuriy G Khait, Cynthia Hardel, et al.
The Journal of Chemical Physics
|
April 20, 2005
Multireference configuration interaction based electronic Floquet states for molecules in an intense radiation field: theory and application to Li(2)+
Yuriy G Khait, Alexander Azenkeng, Hefeng Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 21, 2013
The dissociation of glycolate-astrochemical and prebiotic relevance
Anton Simakov, Glenn B S Miller, Arne J C Bunkan, et al.
The Journal of Chemical Physics
|
December 2, 2009
Comparative study of multireference perturbative theories for ground and excited states
Mark R Hoffmann, Dipayan Datta, Sanghamitra Das, et al.
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of 5