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Physical Chemistry Chemical Physics : PCCP
|
May 17, 2013
Vibrational self-consistent field calculations for spectroscopy of biological molecules: new algorithmic developments and applications
Tapta Kanchan Roy, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
August 7, 2012
Interaction and reaction of the hydroxyl ion with β-D-galactose and its hydrated complex: an ab initio molecular dynamics study
Hong-Bin Xie, R Benny Gerber
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
May 7, 2002
Ab initio calculations of anharmonic vibrational spectroscopy for hydrogen fluoride (HF)n (n = 3, 4) and mixed hydrogen fluoride/water (HF)n(H2O)n (n = 1, 2, 4) clusters
Galina M Chaban, R Benny Gerber
The Journal of Physical Chemistry. A
|
December 13, 2019
Microscopic Mechanisms of N<sub>2</sub>O<sub>5</sub> Hydrolysis on the Surface of Water Droplets
Estefanía Rossich Molina, R Benny Gerber
The Journal of Physical Chemistry. A
|
June 19, 2013
Dynamics of triplet-state photochemistry of pentanal: mechanisms of Norrish I, Norrish II, and H abstraction reactions
Dorit Shemesh, Zhenggang Lan, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
August 13, 2013
When a proton attacks cellobiose in the gas phase: ab initio molecular dynamics simulations
Madeleine Pincu, Brina Brauer, R Benny Gerber
Accounts of Chemical Research
|
August 30, 2008
Noble-gas hydrides: new chemistry at low temperatures
Leonid Khriachtchev, Markku Räsänen, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
June 22, 2013
Destabilization of noble-gas hydrides by a water environment: calculations for HXeOH@(H2O)n, HXeOXeH@(H2O)n, HXeBr@(H2O)n, HXeCCH@(H2O)n
Ehud Tsivion, Markku Räsänen, R Benny Gerber
Journal of Chemical Theory and Computation
|
February 9, 2017
Approximate Quantum Dynamics using Ab Initio Classical Separable Potentials: Spectroscopic Applications
Barak Hirshberg, Lior Sagiv, R Benny Gerber
The Journal of Physical Chemistry. A
|
September 21, 2019
Hydrogenic Stretch Spectroscopy of Glycine-Water Complexes: Anharmonic Ab Initio Classical Separable Potential Calculations
Lior Sagiv, Barak Hirshberg, R Benny Gerber
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Search research articles
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Showing results (21-30 of 144) with videos related to
Sort By:
Page
of 15
Physical Chemistry Chemical Physics : PCCP
|
May 17, 2013
Vibrational self-consistent field calculations for spectroscopy of biological molecules: new algorithmic developments and applications
Tapta Kanchan Roy, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
August 7, 2012
Interaction and reaction of the hydroxyl ion with β-D-galactose and its hydrated complex: an ab initio molecular dynamics study
Hong-Bin Xie, R Benny Gerber
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
May 7, 2002
Ab initio calculations of anharmonic vibrational spectroscopy for hydrogen fluoride (HF)n (n = 3, 4) and mixed hydrogen fluoride/water (HF)n(H2O)n (n = 1, 2, 4) clusters
Galina M Chaban, R Benny Gerber
The Journal of Physical Chemistry. A
|
December 13, 2019
Microscopic Mechanisms of N<sub>2</sub>O<sub>5</sub> Hydrolysis on the Surface of Water Droplets
Estefanía Rossich Molina, R Benny Gerber
The Journal of Physical Chemistry. A
|
June 19, 2013
Dynamics of triplet-state photochemistry of pentanal: mechanisms of Norrish I, Norrish II, and H abstraction reactions
Dorit Shemesh, Zhenggang Lan, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
August 13, 2013
When a proton attacks cellobiose in the gas phase: ab initio molecular dynamics simulations
Madeleine Pincu, Brina Brauer, R Benny Gerber
Accounts of Chemical Research
|
August 30, 2008
Noble-gas hydrides: new chemistry at low temperatures
Leonid Khriachtchev, Markku Räsänen, R Benny Gerber
Physical Chemistry Chemical Physics : PCCP
|
June 22, 2013
Destabilization of noble-gas hydrides by a water environment: calculations for HXeOH@(H2O)n, HXeOXeH@(H2O)n, HXeBr@(H2O)n, HXeCCH@(H2O)n
Ehud Tsivion, Markku Räsänen, R Benny Gerber
Journal of Chemical Theory and Computation
|
February 9, 2017
Approximate Quantum Dynamics using Ab Initio Classical Separable Potentials: Spectroscopic Applications
Barak Hirshberg, Lior Sagiv, R Benny Gerber
The Journal of Physical Chemistry. A
|
September 21, 2019
Hydrogenic Stretch Spectroscopy of Glycine-Water Complexes: Anharmonic Ab Initio Classical Separable Potential Calculations
Lior Sagiv, Barak Hirshberg, R Benny Gerber
Page
of 15