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Journal of Computational Chemistry
|
February 21, 2025
First Principles Global Optimization Method From Parallel Tempering Molecular Dynamics
Gerald Geudtner, Andreas M Köster
The Journal of Chemical Physics
|
April 10, 2008
Auxiliary density perturbation theory
Roberto Flores-Moreno, Andreas M Köster
The Journal of Chemical Physics
|
October 3, 2014
Robust and efficient variational fitting of Fock exchange
Daniel Mejía-Rodríguez, Andreas M Köster
Journal of Computational Chemistry
|
April 30, 2004
Geometry optimization in density functional methods
J Ulises Reveles, Andreas M Köster
The Journal of Chemical Physics
|
July 16, 2008
A hierarchical transition state search algorithm
Jorge M Del Campo, Andreas M Köster
The Journal of Chemical Physics
|
January 14, 2023
Efficient implementation of time-dependent auxiliary density functional theory
Luis I Hernández-Segura, Andreas M Köster
Journal of Chemical Theory and Computation
|
November 27, 2015
First-Principle Calculations of Large Fullerenes
Patrizia Calaminici, Gerald Geudtner, Andreas M Köster
The Journal of Physical Chemistry. A
|
July 13, 2006
13C NMR pattern of Sc3N@C68. Structural assignment of the first fullerene with adjacent pentagons
J Ulises Reveles, Thomas Heine, Andreas M Köster
The Journal of Chemical Physics
|
September 11, 2012
Magnetizability tensors from auxiliary density functional theory
Bernardo Zuniga-Gutierrez, Gerald Geudtner, Andreas M Köster
The Journal of Chemical Physics
|
August 12, 2004
Structures and vibrations of Nb3O and Nb3O-: a density functional study
Patrizia Calaminici, Roberto Flores-Moreno, Andreas M Köster
Page
of 7
Search research articles
Search
Showing results (1-10 of 63) with videos related to
Sort By:
Page
of 7
Journal of Computational Chemistry
|
February 21, 2025
First Principles Global Optimization Method From Parallel Tempering Molecular Dynamics
Gerald Geudtner, Andreas M Köster
The Journal of Chemical Physics
|
April 10, 2008
Auxiliary density perturbation theory
Roberto Flores-Moreno, Andreas M Köster
The Journal of Chemical Physics
|
October 3, 2014
Robust and efficient variational fitting of Fock exchange
Daniel Mejía-Rodríguez, Andreas M Köster
Journal of Computational Chemistry
|
April 30, 2004
Geometry optimization in density functional methods
J Ulises Reveles, Andreas M Köster
The Journal of Chemical Physics
|
July 16, 2008
A hierarchical transition state search algorithm
Jorge M Del Campo, Andreas M Köster
The Journal of Chemical Physics
|
January 14, 2023
Efficient implementation of time-dependent auxiliary density functional theory
Luis I Hernández-Segura, Andreas M Köster
Journal of Chemical Theory and Computation
|
November 27, 2015
First-Principle Calculations of Large Fullerenes
Patrizia Calaminici, Gerald Geudtner, Andreas M Köster
The Journal of Physical Chemistry. A
|
July 13, 2006
13C NMR pattern of Sc3N@C68. Structural assignment of the first fullerene with adjacent pentagons
J Ulises Reveles, Thomas Heine, Andreas M Köster
The Journal of Chemical Physics
|
September 11, 2012
Magnetizability tensors from auxiliary density functional theory
Bernardo Zuniga-Gutierrez, Gerald Geudtner, Andreas M Köster
The Journal of Chemical Physics
|
August 12, 2004
Structures and vibrations of Nb3O and Nb3O-: a density functional study
Patrizia Calaminici, Roberto Flores-Moreno, Andreas M Köster
Page
of 7