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The Journal of Chemical Physics|February 18, 2006
Exact decoupling of the Dirac Hamiltonian. III. Molecular propertiesAlexander Wolf, Markus ReiherThe Journal of Chemical Physics|December 10, 2017
Self-adaptive tensor network states with multi-site correlatorsArseny Kovyrshin, Markus ReiherJournal of Chemical Theory and Computation|June 8, 2023
Lifelong Machine Learning PotentialsMarco Eckhoff, Markus ReiherChemistry (Weinheim an Der Bergstrasse, Germany)|November 26, 2003
From rare gas atoms to fullerenes: spherical aromaticity studied from the point of view of atomic structure theoryMarkus Reiher, Andreas HirschThe Journal of Physical Chemistry Letters|February 21, 2023
Corresponding Active Orbital Spaces along Chemical Reaction PathsMoritz Bensberg, Markus ReiherThe Journal of Chemical Physics|July 19, 2012
Molecular structure calculations: a unified quantum mechanical description of electrons and nuclei using explicitly correlated Gaussian functions and the global vector representationEdit Mátyus, Markus ReiherJournal of Chemical Theory and Computation|August 19, 2024
Renormalized Internally Contracted Multireference Coupled Cluster with Perturbative TriplesRobin Feldmann, Markus ReiherJournal of Chemical Theory and Computation|June 30, 2026
After 100 Years of Quantum Mechanics: Toward a Constructive Observation-Centered PerspectiveTimothy Stroschein, Markus ReiherThe Journal of Physical Chemistry Letters|July 13, 2026
Utility-Scale Quantum Computational ChemistryDavide Castaldo, Markus ReiherThe Journal of Chemical Physics|March 5, 2009
Localizing normal modes in large moleculesChristoph R Jacob, Markus ReiherPageof 26