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Journal of Chemical Theory and Computation
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August 19, 2024
Renormalized Internally Contracted Multireference Coupled Cluster with Perturbative Triples
Robin Feldmann, 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
Journal of Chemical Theory and Computation
|
January 26, 2023
Second-Order Self-Consistent Field Algorithms: From Classical to Quantum Nuclei
Robin Feldmann, Alberto Baiardi, 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
|
January 3, 2022
Quantum Proton Effects from Density Matrix Renormalization Group Calculations
Robin Feldmann, Andrea Muolo, Alberto Baiardi, et al.
The Journal of Physical Chemistry. A
|
September 30, 2024
Complete Active Space Iterative Coupled Cluster Theory
Robin Feldmann, Maximilian Mörchen, Jakub Lang, et al.
The Journal of Physical Chemistry. A
|
February 3, 2026
Efficient Implementation of the Spin-Free Renormalized Internally-Contracted Multireference Coupled Cluster Theory
Kalman Szenes, Riya Kayal, Kantharuban Sivalingam, et al.
The Journal of Physical Chemistry. A
|
August 1, 2025
QCMaquis 4.0: Multipurpose Electronic, Vibrational, and Vibronic Structure and Dynamics Calculations with the Density Matrix Renormalization Group
Kalman Szenes, Nina Glaser, Mihael Erakovic, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
August 19, 2024
Renormalized Internally Contracted Multireference Coupled Cluster with Perturbative Triples
Robin Feldmann, 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
Journal of Chemical Theory and Computation
|
January 26, 2023
Second-Order Self-Consistent Field Algorithms: From Classical to Quantum Nuclei
Robin Feldmann, Alberto Baiardi, 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
|
January 3, 2022
Quantum Proton Effects from Density Matrix Renormalization Group Calculations
Robin Feldmann, Andrea Muolo, Alberto Baiardi, et al.
The Journal of Physical Chemistry. A
|
September 30, 2024
Complete Active Space Iterative Coupled Cluster Theory
Robin Feldmann, Maximilian Mörchen, Jakub Lang, et al.
The Journal of Physical Chemistry. A
|
February 3, 2026
Efficient Implementation of the Spin-Free Renormalized Internally-Contracted Multireference Coupled Cluster Theory
Kalman Szenes, Riya Kayal, Kantharuban Sivalingam, et al.
The Journal of Physical Chemistry. A
|
August 1, 2025
QCMaquis 4.0: Multipurpose Electronic, Vibrational, and Vibronic Structure and Dynamics Calculations with the Density Matrix Renormalization Group
Kalman Szenes, Nina Glaser, Mihael Erakovic, et al.
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of 1