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Journal of the American Chemical Society
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August 22, 2019
Hydrogen Atom or Proton Coupled Electron Transfer? C-H Bond Activation by Transition-Metal Oxides
Carlo Alberto Gaggioli, Joachim Sauer, Laura Gagliardi
Journal of Chemical Theory and Computation
|
March 29, 2020
Thermochemistry of FeO<i></i>H<i></i> Species: Assessment of Some DFT Functionals
Marc Reimann, Florian A Bischoff, Joachim Sauer
Journal of the American Chemical Society
|
January 22, 2004
Computational elucidation of the transition state shape selectivity phenomenon
Louis A Clark, Marek Sierka, Joachim Sauer
The Journal of Chemical Physics
|
July 23, 2004
Electronic ground states of the V2O4+/0/- species from multireference correlation and density functional studies
Mikhail Pykavy, Christoph Van Wullen, Joachim Sauer
Physical Chemistry Chemical Physics : PCCP
|
March 18, 2009
Protonation of water clusters in the cavities of acidic zeolites: (H2O)n.H-chabazite, n = 1-4
Mikhail V Vener, Xavier Rozanska, Joachim Sauer
Faraday Discussions
|
September 11, 2013
Stability and migration barriers of small vanadium oxide clusters on the CeO2(111) surface studied by density functional theory
Joachim Paier, Thomas Kropp, Christopher Penschke, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 27, 2014
Structure and properties of bimetallic titanium and vanadium oxide clusters
Benjamin Helmich, Marek Sierka, Jens Döbler, et al.
Journal of Chemical Theory and Computation
|
February 8, 2024
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111)
Christopher Sheldon, Joachim Paier, Denis Usvyat, et al.
The Journal of Physical Chemistry. B
|
December 27, 2005
Vanadium oxides on aluminum oxide supports. 2. Structure, vibrational properties, and reducibility of V2O5 clusters on alpha-Al2O3(0001)
Veronika Brázdová, M Verónica Ganduglia-Pirovano, Joachim Sauer
Journal of the American Chemical Society
|
October 18, 2016
Ab Initio Prediction of Adsorption Isotherms for Small Molecules in Metal-Organic Frameworks
Arpan Kundu, GiovanniMaria Piccini, Kaido Sillar, et al.
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of 14
Search research articles
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Showing results (41-50 of 131) with videos related to
Sort By:
Page
of 14
Journal of the American Chemical Society
|
August 22, 2019
Hydrogen Atom or Proton Coupled Electron Transfer? C-H Bond Activation by Transition-Metal Oxides
Carlo Alberto Gaggioli, Joachim Sauer, Laura Gagliardi
Journal of Chemical Theory and Computation
|
March 29, 2020
Thermochemistry of FeO<i></i>H<i></i> Species: Assessment of Some DFT Functionals
Marc Reimann, Florian A Bischoff, Joachim Sauer
Journal of the American Chemical Society
|
January 22, 2004
Computational elucidation of the transition state shape selectivity phenomenon
Louis A Clark, Marek Sierka, Joachim Sauer
The Journal of Chemical Physics
|
July 23, 2004
Electronic ground states of the V2O4+/0/- species from multireference correlation and density functional studies
Mikhail Pykavy, Christoph Van Wullen, Joachim Sauer
Physical Chemistry Chemical Physics : PCCP
|
March 18, 2009
Protonation of water clusters in the cavities of acidic zeolites: (H2O)n.H-chabazite, n = 1-4
Mikhail V Vener, Xavier Rozanska, Joachim Sauer
Faraday Discussions
|
September 11, 2013
Stability and migration barriers of small vanadium oxide clusters on the CeO2(111) surface studied by density functional theory
Joachim Paier, Thomas Kropp, Christopher Penschke, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 27, 2014
Structure and properties of bimetallic titanium and vanadium oxide clusters
Benjamin Helmich, Marek Sierka, Jens Döbler, et al.
Journal of Chemical Theory and Computation
|
February 8, 2024
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111)
Christopher Sheldon, Joachim Paier, Denis Usvyat, et al.
The Journal of Physical Chemistry. B
|
December 27, 2005
Vanadium oxides on aluminum oxide supports. 2. Structure, vibrational properties, and reducibility of V2O5 clusters on alpha-Al2O3(0001)
Veronika Brázdová, M Verónica Ganduglia-Pirovano, Joachim Sauer
Journal of the American Chemical Society
|
October 18, 2016
Ab Initio Prediction of Adsorption Isotherms for Small Molecules in Metal-Organic Frameworks
Arpan Kundu, GiovanniMaria Piccini, Kaido Sillar, et al.
Page
of 14