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Klaus Ruedenberg

Showing results (31-40 of 43) with videos related to

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The Journal of Physical Chemistry. A|June 15, 2019
Quasi-Atomic Bond Analyses in the Sixth Period: II. Bond Analyses of Cerium OxidesGeorge Schoendorff, Michael W Schmidt, Klaus Ruedenberg, et al.
The Journal of Physical Chemistry. A|September 17, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic, Quasi-Atomic Orbitals. II. Strongly Correlated MCSCF Wave FunctionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|January 31, 2017
Intrinsic Resolution of Molecular Electronic Wave Functions and Energies in Terms of Quasi-atoms and Their InteractionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|September 16, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic, Quasi-Atomic Orbitals. III. The Covalent Bonding Structure of UreaAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Chemical Physics|December 24, 2013
A comprehensive analysis of molecule-intrinsic quasi-atomic, bonding, and correlating orbitals. I. Hartree-Fock wave functionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|July 30, 2010
Analysis of bonding patterns in the valence isoelectronic series O(3), S(3), SO(2), and OS(2) in terms of oriented quasi-atomic molecular orbitalsVassiliki-Alexandra Glezakou, Stephen T Elbert, Sotiris S Xantheas, et al.
The Journal of Chemical Physics|July 5, 2012
The dispersion interaction between quantum mechanics and effective fragment potential moleculesQuentin A Smith, Klaus Ruedenberg, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|September 16, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic Quasi-Atomic Orbitals. IV. Bond Breaking and Bond Forming along the Dissociative Reaction Path of DioxetaneAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|November 15, 2017
Identification and Characterization of Molecular Bonding Structures by ab initio Quasi-Atomic Orbital AnalysesAaron C West, Juan J Duchimaza-Heredia, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|June 15, 2019
Quasi-Atomic Bond Analyses in the Sixth Period: I. Relativistic Accurate Atomic Minimal Basis Sets for the Elements Cesium to RadonGeorge Schoendorff, Aaron C West, Michael W Schmidt, et al.
Pageof 5

Showing results (31-40 of 43) with videos related to

Sort By:
Pageof 5
The Journal of Physical Chemistry. A|June 15, 2019
Quasi-Atomic Bond Analyses in the Sixth Period: II. Bond Analyses of Cerium OxidesGeorge Schoendorff, Michael W Schmidt, Klaus Ruedenberg, et al.
The Journal of Physical Chemistry. A|September 17, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic, Quasi-Atomic Orbitals. II. Strongly Correlated MCSCF Wave FunctionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|January 31, 2017
Intrinsic Resolution of Molecular Electronic Wave Functions and Energies in Terms of Quasi-atoms and Their InteractionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|September 16, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic, Quasi-Atomic Orbitals. III. The Covalent Bonding Structure of UreaAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Chemical Physics|December 24, 2013
A comprehensive analysis of molecule-intrinsic quasi-atomic, bonding, and correlating orbitals. I. Hartree-Fock wave functionsAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|July 30, 2010
Analysis of bonding patterns in the valence isoelectronic series O(3), S(3), SO(2), and OS(2) in terms of oriented quasi-atomic molecular orbitalsVassiliki-Alexandra Glezakou, Stephen T Elbert, Sotiris S Xantheas, et al.
The Journal of Chemical Physics|July 5, 2012
The dispersion interaction between quantum mechanics and effective fragment potential moleculesQuentin A Smith, Klaus Ruedenberg, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|September 16, 2015
A Comprehensive Analysis in Terms of Molecule-Intrinsic Quasi-Atomic Orbitals. IV. Bond Breaking and Bond Forming along the Dissociative Reaction Path of DioxetaneAaron C West, Michael W Schmidt, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|November 15, 2017
Identification and Characterization of Molecular Bonding Structures by ab initio Quasi-Atomic Orbital AnalysesAaron C West, Juan J Duchimaza-Heredia, Mark S Gordon, et al.
The Journal of Physical Chemistry. A|June 15, 2019
Quasi-Atomic Bond Analyses in the Sixth Period: I. Relativistic Accurate Atomic Minimal Basis Sets for the Elements Cesium to RadonGeorge Schoendorff, Aaron C West, Michael W Schmidt, et al.
Pageof 5