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The Journal of Physical Chemistry. A
|
March 9, 2018
Identification of Intermediates during the Hydration of Na<sub>8</sub>[AlSiO<sub>4</sub>]<sub>6</sub>(BH<sub>4</sub>)<sub>2</sub>: A Combined Theoretical and Experimental Approach
Alexander G Schneider, Lars Schomborg, Claus H Rüscher, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 21, 2011
System-dependent dispersion coefficients for the DFT-D3 treatment of adsorption processes on ionic surfaces
Stephan Ehrlich, Jonas Moellmann, Werner Reckien, et al.
The Journal of Physical Chemistry. A
|
July 26, 2014
Structure and IR vibrational spectra of Na8[AlSiO4]6(BH4)2: comparison of theory and experiment
Alexander G Schneider, Thomas Bredow, Lars Schomborg, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Structural and electronic properties of Li(2)b(4)O(7)
Mazharul M Islam, Volodymyr V Maslyuk, Thomas Bredow, et al.
Journal of Computational Chemistry
|
July 2, 2019
BSSE-correction scheme for consistent gaussian basis sets of double- and triple-zeta valence with polarization quality for solid-state calculations
Daniel Vilela Oliveira, Joachim Laun, Michael F Peintinger, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 13, 2025
Phase Stabilities and Influence on Magnetic and Electrical Properties of the System (Mg<sub>x</sub>Mn<sub>4-x</sub>)MnVO<sub>8</sub>
Jonas Fraune, Thomas Bredow, Sylvia Kunz, et al.
Journal of Chemical Theory and Computation
|
December 2, 2015
Geometries of Third-Row Transition-Metal Complexes from Density-Functional Theory
Michael Bühl, Christoph Reimann, Dimitrios A Pantazis, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 12, 2006
ATR-FTIR measurements and quantum chemical calculations concerning the adsorption and photoreaction of oxalic acid on TiO2
Cecilia B Mendive, Thomas Bredow, Miguel A Blesa, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
February 3, 2015
On the DFT ground state of crystalline bromine and iodine
Janine George, Christoph Reimann, Volker L Deringer, et al.
Journal of Computational Chemistry
|
November 17, 2017
BonnMag: Computer program for ligand-field analysis of f <sup>n</sup> systems within the angular overlap model
Anna Bronova, Thomas Bredow, Robert Glaum, et al.
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Search research articles
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Showing results (61-70 of 98) with videos related to
Sort By:
Page
of 10
The Journal of Physical Chemistry. A
|
March 9, 2018
Identification of Intermediates during the Hydration of Na<sub>8</sub>[AlSiO<sub>4</sub>]<sub>6</sub>(BH<sub>4</sub>)<sub>2</sub>: A Combined Theoretical and Experimental Approach
Alexander G Schneider, Lars Schomborg, Claus H Rüscher, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 21, 2011
System-dependent dispersion coefficients for the DFT-D3 treatment of adsorption processes on ionic surfaces
Stephan Ehrlich, Jonas Moellmann, Werner Reckien, et al.
The Journal of Physical Chemistry. A
|
July 26, 2014
Structure and IR vibrational spectra of Na8[AlSiO4]6(BH4)2: comparison of theory and experiment
Alexander G Schneider, Thomas Bredow, Lars Schomborg, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Structural and electronic properties of Li(2)b(4)O(7)
Mazharul M Islam, Volodymyr V Maslyuk, Thomas Bredow, et al.
Journal of Computational Chemistry
|
July 2, 2019
BSSE-correction scheme for consistent gaussian basis sets of double- and triple-zeta valence with polarization quality for solid-state calculations
Daniel Vilela Oliveira, Joachim Laun, Michael F Peintinger, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 13, 2025
Phase Stabilities and Influence on Magnetic and Electrical Properties of the System (Mg<sub>x</sub>Mn<sub>4-x</sub>)MnVO<sub>8</sub>
Jonas Fraune, Thomas Bredow, Sylvia Kunz, et al.
Journal of Chemical Theory and Computation
|
December 2, 2015
Geometries of Third-Row Transition-Metal Complexes from Density-Functional Theory
Michael Bühl, Christoph Reimann, Dimitrios A Pantazis, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 12, 2006
ATR-FTIR measurements and quantum chemical calculations concerning the adsorption and photoreaction of oxalic acid on TiO2
Cecilia B Mendive, Thomas Bredow, Miguel A Blesa, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
February 3, 2015
On the DFT ground state of crystalline bromine and iodine
Janine George, Christoph Reimann, Volker L Deringer, et al.
Journal of Computational Chemistry
|
November 17, 2017
BonnMag: Computer program for ligand-field analysis of f <sup>n</sup> systems within the angular overlap model
Anna Bronova, Thomas Bredow, Robert Glaum, et al.
Page
of 10