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Bernd A Hess

Showing results (1-10 of 9) with videos related to

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The Journal of Chemical Physics|July 23, 2004
The structure of the second-order reduced density matrix in density matrix functional theory and its construction from formal criteriaChristian Kollmar, Bernd A Hess
The Journal of Chemical Physics|July 23, 2004
Resonance Raman spectra of uracil based on Kramers-Kronig relations using time-dependent density functional calculations and multireference perturbation theoryJohannes Neugebauer, Bernd A Hess
The Journal of Chemical Physics|March 3, 2005
Comparative analysis of local spin definitionsCarmen Herrmann, Markus Reiher, Bernd A Hess
Chemistry (Weinheim an Der Bergstrasse, Germany)|March 27, 2003
A quantum chemical study of racemization pathways in substituted chrysene derivativesCarsten Kind, Andreas W Götz, Bernd A Hess
Journal of Computational Chemistry|June 18, 2005
Optimization of auxiliary basis sets for the LEDO expansion and a projection technique for LEDO-DFTAndreas W Götz, Christian Kollmar, Bernd A Hess
Journal of Computational Chemistry|May 2, 2002
Quantum chemical calculation of vibrational spectra of large molecules--Raman and IR spectra for BuckminsterfullereneJohannes Neugebauer, Markus Reiher, Carsten Kind, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|November 20, 2004
Car-Parrinello molecular dynamics study of the initial dinitrogen reduction step in Sellmann-type nitrogenase model complexesBarbara Kirchner, Markus Reiher, Andreas Hille, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 16, 2003
Iron carbonyl, nitrosyl, and nitro complexes of a tetrapodal pentadentate amine ligand: synthesis, electronic structure, and nitrite reductase-like reactivityJesús Pitarch López, Frank W Heinemann, Raju Prakash, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 14, 2004
Synthesis, structure, and dynamics of six-membered metallacoronands and metallodendrimers of iron and indiumRolf W Saalfrank, Christian Deutscher, Harald Maid, et al.
Pageof 1

Showing results (1-10 of 9) with videos related to

Sort By:
Pageof 1
The Journal of Chemical Physics|July 23, 2004
The structure of the second-order reduced density matrix in density matrix functional theory and its construction from formal criteriaChristian Kollmar, Bernd A Hess
The Journal of Chemical Physics|July 23, 2004
Resonance Raman spectra of uracil based on Kramers-Kronig relations using time-dependent density functional calculations and multireference perturbation theoryJohannes Neugebauer, Bernd A Hess
The Journal of Chemical Physics|March 3, 2005
Comparative analysis of local spin definitionsCarmen Herrmann, Markus Reiher, Bernd A Hess
Chemistry (Weinheim an Der Bergstrasse, Germany)|March 27, 2003
A quantum chemical study of racemization pathways in substituted chrysene derivativesCarsten Kind, Andreas W Götz, Bernd A Hess
Journal of Computational Chemistry|June 18, 2005
Optimization of auxiliary basis sets for the LEDO expansion and a projection technique for LEDO-DFTAndreas W Götz, Christian Kollmar, Bernd A Hess
Journal of Computational Chemistry|May 2, 2002
Quantum chemical calculation of vibrational spectra of large molecules--Raman and IR spectra for BuckminsterfullereneJohannes Neugebauer, Markus Reiher, Carsten Kind, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|November 20, 2004
Car-Parrinello molecular dynamics study of the initial dinitrogen reduction step in Sellmann-type nitrogenase model complexesBarbara Kirchner, Markus Reiher, Andreas Hille, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 16, 2003
Iron carbonyl, nitrosyl, and nitro complexes of a tetrapodal pentadentate amine ligand: synthesis, electronic structure, and nitrite reductase-like reactivityJesús Pitarch López, Frank W Heinemann, Raju Prakash, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 14, 2004
Synthesis, structure, and dynamics of six-membered metallacoronands and metallodendrimers of iron and indiumRolf W Saalfrank, Christian Deutscher, Harald Maid, et al.
Pageof 1