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The Journal of Physical Chemistry. B
|
November 23, 2012
Water adsorption at two unsolvated peptides with a protonated lysine residue: from self-solvation to solvation
Sucismita Chutia, Mariana Rossi, Volker Blum
Journal of Chemical Information and Modeling
|
October 21, 2015
First-Principles Molecular Structure Search with a Genetic Algorithm
Adriana Supady, Volker Blum, Carsten Baldauf
The Journal of Physical Chemistry. B
|
April 11, 2013
Impact of vibrational entropy on the stability of unsolvated peptide helices with increasing length
Mariana Rossi, Matthias Scheffler, Volker Blum
Physical Review Letters
|
August 27, 2013
Thermodynamic equilibrium conditions of graphene films on SiC
Lydia Nemec, Volker Blum, Patrick Rinke, et al.
The Journal of Physical Chemistry. A
|
January 11, 2014
Validation challenge of density-functional theory for peptides-example of Ac-Phe-Ala5-LysH(+)
Mariana Rossi, Sucismita Chutia, Matthias Scheffler, et al.
Scientific Data
|
February 17, 2016
First-principles data set of 45,892 isolated and cation-coordinated conformers of 20 proteinogenic amino acids
Matti Ropo, Markus Schneider, Carsten Baldauf, et al.
The Journal of Chemical Physics
|
July 9, 2021
Accurate frozen core approximation for all-electron density-functional theory
Victor Wen-Zhe Yu, Jonathan Moussa, Volker Blum
The Journal of Chemical Physics
|
September 23, 2020
Relativistic correction scheme for core-level binding energies from GW
Levi Keller, Volker Blum, Patrick Rinke, et al.
The Journal of Chemical Physics
|
February 20, 2025
Exploring atom-pairwise and many-body dispersion corrections for the BEEF-vdW functional
Elisabeth Keller, Volker Blum, Karsten Reuter, et al.
Physical Review Letters
|
September 10, 2025
Chiral Phonon-Induced Spin Transport via Microscopic Barnett Effect
Xixi Qin, Cong Yang, Dali Sun, et al.
Page
of 7
Search research articles
Search
Showing results (1-10 of 67) with videos related to
Sort By:
Page
of 7
The Journal of Physical Chemistry. B
|
November 23, 2012
Water adsorption at two unsolvated peptides with a protonated lysine residue: from self-solvation to solvation
Sucismita Chutia, Mariana Rossi, Volker Blum
Journal of Chemical Information and Modeling
|
October 21, 2015
First-Principles Molecular Structure Search with a Genetic Algorithm
Adriana Supady, Volker Blum, Carsten Baldauf
The Journal of Physical Chemistry. B
|
April 11, 2013
Impact of vibrational entropy on the stability of unsolvated peptide helices with increasing length
Mariana Rossi, Matthias Scheffler, Volker Blum
Physical Review Letters
|
August 27, 2013
Thermodynamic equilibrium conditions of graphene films on SiC
Lydia Nemec, Volker Blum, Patrick Rinke, et al.
The Journal of Physical Chemistry. A
|
January 11, 2014
Validation challenge of density-functional theory for peptides-example of Ac-Phe-Ala5-LysH(+)
Mariana Rossi, Sucismita Chutia, Matthias Scheffler, et al.
Scientific Data
|
February 17, 2016
First-principles data set of 45,892 isolated and cation-coordinated conformers of 20 proteinogenic amino acids
Matti Ropo, Markus Schneider, Carsten Baldauf, et al.
The Journal of Chemical Physics
|
July 9, 2021
Accurate frozen core approximation for all-electron density-functional theory
Victor Wen-Zhe Yu, Jonathan Moussa, Volker Blum
The Journal of Chemical Physics
|
September 23, 2020
Relativistic correction scheme for core-level binding energies from GW
Levi Keller, Volker Blum, Patrick Rinke, et al.
The Journal of Chemical Physics
|
February 20, 2025
Exploring atom-pairwise and many-body dispersion corrections for the BEEF-vdW functional
Elisabeth Keller, Volker Blum, Karsten Reuter, et al.
Physical Review Letters
|
September 10, 2025
Chiral Phonon-Induced Spin Transport via Microscopic Barnett Effect
Xixi Qin, Cong Yang, Dali Sun, et al.
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of 7