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Journal of Chemical Theory and Computation
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November 26, 2015
Two-Component Relativistic Calculations of Electric-Field Gradients Using Exact Decoupling Methods: Spin-orbit and Picture-Change Effects
Jochen Autschbach, Daoling Peng, Markus Reiher
The Journal of Chemical Physics
|
December 31, 2020
Tailored coupled cluster theory in varying correlation regimes
Maximilian Mörchen, Leon Freitag, Markus Reiher
The Journal of Chemical Physics
|
February 12, 2015
Communication: four-component density matrix renormalization group
Stefan Knecht, Örs Legeza, Markus Reiher
Journal of Chemical Theory and Computation
|
December 7, 2023
Flexible DMRG-Based Framework for Anharmonic Vibrational Calculations
Nina Glaser, Alberto Baiardi, Markus Reiher
The Journal of Physical Chemistry. A
|
October 13, 2023
Symmetry-Projected Nuclear-Electronic Hartree-Fock: Eliminating Rotational Energy Contamination
Robin Feldmann, Alberto Baiardi, Markus Reiher
The Journal of Chemical Physics
|
December 3, 2008
Selective calculation of high-intensity vibrations in molecular resonance Raman spectra
Karin Kiewisch, Johannes Neugebauer, Markus Reiher
Journal of Chemical Theory and Computation
|
June 6, 2022
Explicitly Correlated Electronic Structure Calculations with Transcorrelated Matrix Product Operators
Alberto Baiardi, Michał Lesiuk, Markus Reiher
The Journal of Physical Chemistry. A
|
April 25, 2024
Tribute to Roland Lindh
Leticia González, Markus Reiher, Julia Rice
Journal of Chemical Theory and Computation
|
October 12, 2019
Gaussian Process-Based Refinement of Dispersion Corrections
Jonny Proppe, Stefan Gugler, Markus Reiher
Journal of Computational Chemistry
|
June 10, 2006
Spin states in polynuclear clusters: the [Fe2O2] core of the methane monooxygenase active site
Carmen Herrmann, Lian Yu, Markus Reiher
Page
of 27
Search research articles
Search
Showing results (91-100 of 270) with videos related to
Sort By:
Page
of 27
Journal of Chemical Theory and Computation
|
November 26, 2015
Two-Component Relativistic Calculations of Electric-Field Gradients Using Exact Decoupling Methods: Spin-orbit and Picture-Change Effects
Jochen Autschbach, Daoling Peng, Markus Reiher
The Journal of Chemical Physics
|
December 31, 2020
Tailored coupled cluster theory in varying correlation regimes
Maximilian Mörchen, Leon Freitag, Markus Reiher
The Journal of Chemical Physics
|
February 12, 2015
Communication: four-component density matrix renormalization group
Stefan Knecht, Örs Legeza, Markus Reiher
Journal of Chemical Theory and Computation
|
December 7, 2023
Flexible DMRG-Based Framework for Anharmonic Vibrational Calculations
Nina Glaser, Alberto Baiardi, Markus Reiher
The Journal of Physical Chemistry. A
|
October 13, 2023
Symmetry-Projected Nuclear-Electronic Hartree-Fock: Eliminating Rotational Energy Contamination
Robin Feldmann, Alberto Baiardi, Markus Reiher
The Journal of Chemical Physics
|
December 3, 2008
Selective calculation of high-intensity vibrations in molecular resonance Raman spectra
Karin Kiewisch, Johannes Neugebauer, Markus Reiher
Journal of Chemical Theory and Computation
|
June 6, 2022
Explicitly Correlated Electronic Structure Calculations with Transcorrelated Matrix Product Operators
Alberto Baiardi, Michał Lesiuk, Markus Reiher
The Journal of Physical Chemistry. A
|
April 25, 2024
Tribute to Roland Lindh
Leticia González, Markus Reiher, Julia Rice
Journal of Chemical Theory and Computation
|
October 12, 2019
Gaussian Process-Based Refinement of Dispersion Corrections
Jonny Proppe, Stefan Gugler, Markus Reiher
Journal of Computational Chemistry
|
June 10, 2006
Spin states in polynuclear clusters: the [Fe2O2] core of the methane monooxygenase active site
Carmen Herrmann, Lian Yu, Markus Reiher
Page
of 27