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The Journal of Chemical Physics
|
June 21, 2011
Construction of CASCI-type wave functions for very large active spaces
Katharina Boguslawski, Konrad H Marti, Markus Reiher
Inorganic Chemistry
|
December 17, 2013
Theoretical 57Fe Mössbauer spectroscopy for structure elucidation of [Fe] hydrogenase active site intermediates
Joël Gubler, Arndt R Finkelmann, Markus Reiher
The Journal of Physical Chemistry. B
|
April 14, 2009
Analysis of secondary structure effects on the IR and Raman spectra of polypeptides in terms of localized vibrations
Christoph R Jacob, Sandra Luber, Markus Reiher
The Journal of Physical Chemistry Letters
|
April 23, 2026
Neural Quantum States Based on Selected Configurations
Marco Julian Solanki, Lexin Ding, Markus Reiher
The Journal of Chemical Physics
|
June 4, 2020
Nuclear-electronic all-particle density matrix renormalization group
Andrea Muolo, Alberto Baiardi, Robin Feldmann, et al.
Journal of Chemical Theory and Computation
|
August 4, 2022
Chemoton 2.0: Autonomous Exploration of Chemical Reaction Networks
Jan P Unsleber, Stephanie A Grimmel, Markus Reiher
Journal of Chemical Theory and Computation
|
January 3, 2022
Quantum Proton Effects from Density Matrix Renormalization Group Calculations
Robin Feldmann, Andrea Muolo, Alberto Baiardi, et al.
Journal of Chemical Theory and Computation
|
January 21, 2016
Accelerating Wave Function Convergence in Interactive Quantum Chemical Reactivity Studies
Adrian H Mühlbach, Alain C Vaucher, Markus Reiher
The Journal of Physical Chemistry Letters
|
August 22, 2015
Entanglement Measures for Single- and Multireference Correlation Effects
Katharina Boguslawski, Pawel̷ Tecmer, Örs Legeza, et al.
Journal of Computational Chemistry
|
February 7, 2020
Systematic microsolvation approach with a cluster-continuum scheme and conformational sampling
Gregor N Simm, Paul L Türtscher, Markus Reiher
Page
of 27
Search research articles
Search
Showing results (131-140 of 270) with videos related to
Sort By:
Page
of 27
The Journal of Chemical Physics
|
June 21, 2011
Construction of CASCI-type wave functions for very large active spaces
Katharina Boguslawski, Konrad H Marti, Markus Reiher
Inorganic Chemistry
|
December 17, 2013
Theoretical 57Fe Mössbauer spectroscopy for structure elucidation of [Fe] hydrogenase active site intermediates
Joël Gubler, Arndt R Finkelmann, Markus Reiher
The Journal of Physical Chemistry. B
|
April 14, 2009
Analysis of secondary structure effects on the IR and Raman spectra of polypeptides in terms of localized vibrations
Christoph R Jacob, Sandra Luber, Markus Reiher
The Journal of Physical Chemistry Letters
|
April 23, 2026
Neural Quantum States Based on Selected Configurations
Marco Julian Solanki, Lexin Ding, Markus Reiher
The Journal of Chemical Physics
|
June 4, 2020
Nuclear-electronic all-particle density matrix renormalization group
Andrea Muolo, Alberto Baiardi, Robin Feldmann, et al.
Journal of Chemical Theory and Computation
|
August 4, 2022
Chemoton 2.0: Autonomous Exploration of Chemical Reaction Networks
Jan P Unsleber, Stephanie A Grimmel, Markus Reiher
Journal of Chemical Theory and Computation
|
January 3, 2022
Quantum Proton Effects from Density Matrix Renormalization Group Calculations
Robin Feldmann, Andrea Muolo, Alberto Baiardi, et al.
Journal of Chemical Theory and Computation
|
January 21, 2016
Accelerating Wave Function Convergence in Interactive Quantum Chemical Reactivity Studies
Adrian H Mühlbach, Alain C Vaucher, Markus Reiher
The Journal of Physical Chemistry Letters
|
August 22, 2015
Entanglement Measures for Single- and Multireference Correlation Effects
Katharina Boguslawski, Pawel̷ Tecmer, Örs Legeza, et al.
Journal of Computational Chemistry
|
February 7, 2020
Systematic microsolvation approach with a cluster-continuum scheme and conformational sampling
Gregor N Simm, Paul L Türtscher, Markus Reiher
Page
of 27