Search research articles
Contact Us
Filters
Showing results (51-60 of 105) with videos related to
Page
of 11
Sort By:
The Journal of Chemical Physics
|
June 30, 2007
Proton momentum distribution in water: an open path integral molecular dynamics study
Joseph A Morrone, Varadharajan Srinivasan, Daniel Sebastiani, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 11, 2008
Beyond isotropic tumbling models: nuclear spin relaxation in liquids from first principles
Jochen Schmidt, Jürg Hutter, Hans-Wolfgang Spiess, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 11, 2007
Selectivity of guest-host interactions in self-assembled hydrogen-bonded nanostructures observed by NMR
Gunther Brunklaus, Achim Koch, Daniel Sebastiani, et al.
The Journal of Physical Chemistry. A
|
April 8, 2017
Improved Quantum Chemical NMR Chemical Shift Prediction of Metabolites in Aqueous Solution toward the Validation of Unknowns
Felix Hoffmann, Da-Wei Li, Daniel Sebastiani, et al.
Angewandte Chemie (International Ed. in English)
|
January 4, 2013
An ab initio microscope: molecular contributions to the femtosecond time-dependent fluorescence shift of a Reichardt-type dye
Christoph Allolio, Mohsen Sajadi, Nikolaus P Ernsting, et al.
Journal of the American Chemical Society
|
March 24, 2009
Columnar packing motifs of functionalized perylene derivatives: local molecular order despite long-range disorder
Michael Ryan Hansen, Robert Graf, Sivakumar Sekharan, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
June 24, 2010
Local disorder in hydrogen storage compounds: the case of lithium amide/imide
Guillermo A Ludueña, Martin Wegner, Lars Bjålie, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 31, 2006
First principles and experimental 1H NMR signatures of solvated ions: The case of HCl(aq)
Tatiana Murakhtina, Jasper Heuft, Evert Jan Meijer, et al.
Physical Review Letters
|
November 5, 2004
Optimization of effective atom centered potentials for london dispersion forces in density functional theory
O Anatole von Lilienfeld, Ivano Tavernelli, Ursula Rothlisberger, et al.
The Journal of Chemical Physics
|
January 11, 2005
Variational optimization of effective atom centered potentials for molecular properties
O Anatole von Lilienfeld, Ivano Tavernelli, Ursula Rothlisberger, et al.
Page
of 11
Search research articles
Search
Showing results (51-60 of 105) with videos related to
Sort By:
Page
of 11
The Journal of Chemical Physics
|
June 30, 2007
Proton momentum distribution in water: an open path integral molecular dynamics study
Joseph A Morrone, Varadharajan Srinivasan, Daniel Sebastiani, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 11, 2008
Beyond isotropic tumbling models: nuclear spin relaxation in liquids from first principles
Jochen Schmidt, Jürg Hutter, Hans-Wolfgang Spiess, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 11, 2007
Selectivity of guest-host interactions in self-assembled hydrogen-bonded nanostructures observed by NMR
Gunther Brunklaus, Achim Koch, Daniel Sebastiani, et al.
The Journal of Physical Chemistry. A
|
April 8, 2017
Improved Quantum Chemical NMR Chemical Shift Prediction of Metabolites in Aqueous Solution toward the Validation of Unknowns
Felix Hoffmann, Da-Wei Li, Daniel Sebastiani, et al.
Angewandte Chemie (International Ed. in English)
|
January 4, 2013
An ab initio microscope: molecular contributions to the femtosecond time-dependent fluorescence shift of a Reichardt-type dye
Christoph Allolio, Mohsen Sajadi, Nikolaus P Ernsting, et al.
Journal of the American Chemical Society
|
March 24, 2009
Columnar packing motifs of functionalized perylene derivatives: local molecular order despite long-range disorder
Michael Ryan Hansen, Robert Graf, Sivakumar Sekharan, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
June 24, 2010
Local disorder in hydrogen storage compounds: the case of lithium amide/imide
Guillermo A Ludueña, Martin Wegner, Lars Bjålie, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 31, 2006
First principles and experimental 1H NMR signatures of solvated ions: The case of HCl(aq)
Tatiana Murakhtina, Jasper Heuft, Evert Jan Meijer, et al.
Physical Review Letters
|
November 5, 2004
Optimization of effective atom centered potentials for london dispersion forces in density functional theory
O Anatole von Lilienfeld, Ivano Tavernelli, Ursula Rothlisberger, et al.
The Journal of Chemical Physics
|
January 11, 2005
Variational optimization of effective atom centered potentials for molecular properties
O Anatole von Lilienfeld, Ivano Tavernelli, Ursula Rothlisberger, et al.
Page
of 11