Search research articles
Contact Us
Filters
Showing results (1-10 of 94) with videos related to
Page
of 10
Sort By:
The Journal of Chemical Physics
|
December 3, 2016
Communication: Multipole approximations of distant pair energies in local correlation methods with pair natural orbitals
Hans-Joachim Werner
The Journal of Chemical Physics
|
December 3, 2008
Eliminating the domain error in local explicitly correlated second-order Møller-Plesset perturbation theory
Hans-Joachim Werner
Journal of Chemical Theory and Computation
|
July 24, 2023
Accurate Calculation of Isomerization and Conformational Energies of Larger Molecules Using Explicitly Correlated Local Coupled Cluster Methods in Molpro and ORCA
Hans-Joachim Werner, Andreas Hansen
The Journal of Chemical Physics
|
October 21, 2011
An efficient local coupled cluster method for accurate thermochemistry of large systems
Hans-Joachim Werner, Martin Schütz
The Journal of Chemical Physics
|
April 25, 2008
Explicitly correlated RMP2 for high-spin open-shell reference states
Gerald Knizia, Hans-Joachim Werner
Physical Chemistry Chemical Physics : PCCP
|
June 7, 2008
Accurate calculations of intermolecular interaction energies using explicitly correlated wave functions
Oliver Marchetti, Hans-Joachim Werner
The Journal of Chemical Physics
|
October 19, 2010
Communication: Second-order multireference perturbation theory with explicit correlation: CASPT2-F12
Toru Shiozaki, Hans-Joachim Werner
Journal of Chemical Theory and Computation
|
December 21, 2018
Scalable Electron Correlation Methods. 6. Local Spin-Restricted Open-Shell Second-Order Møller-Plesset Perturbation Theory Using Pair Natural Orbitals: PNO-RMP2
Christine Krause, Hans-Joachim Werner
The Journal of Physical Chemistry. A
|
October 8, 2009
Accurate calculations of intermolecular interaction energies using explicitly correlated coupled cluster wave functions and a dispersion-weighted MP2 method
Oliver Marchetti, Hans-Joachim Werner
The Journal of Chemical Physics
|
May 17, 2011
Explicitly correlated multireference configuration interaction with multiple reference functions: avoided crossings and conical intersections
Toru Shiozaki, Hans-Joachim Werner
Page
of 10
Search research articles
Search
Showing results (1-10 of 94) with videos related to
Sort By:
Page
of 10
The Journal of Chemical Physics
|
December 3, 2016
Communication: Multipole approximations of distant pair energies in local correlation methods with pair natural orbitals
Hans-Joachim Werner
The Journal of Chemical Physics
|
December 3, 2008
Eliminating the domain error in local explicitly correlated second-order Møller-Plesset perturbation theory
Hans-Joachim Werner
Journal of Chemical Theory and Computation
|
July 24, 2023
Accurate Calculation of Isomerization and Conformational Energies of Larger Molecules Using Explicitly Correlated Local Coupled Cluster Methods in Molpro and ORCA
Hans-Joachim Werner, Andreas Hansen
The Journal of Chemical Physics
|
October 21, 2011
An efficient local coupled cluster method for accurate thermochemistry of large systems
Hans-Joachim Werner, Martin Schütz
The Journal of Chemical Physics
|
April 25, 2008
Explicitly correlated RMP2 for high-spin open-shell reference states
Gerald Knizia, Hans-Joachim Werner
Physical Chemistry Chemical Physics : PCCP
|
June 7, 2008
Accurate calculations of intermolecular interaction energies using explicitly correlated wave functions
Oliver Marchetti, Hans-Joachim Werner
The Journal of Chemical Physics
|
October 19, 2010
Communication: Second-order multireference perturbation theory with explicit correlation: CASPT2-F12
Toru Shiozaki, Hans-Joachim Werner
Journal of Chemical Theory and Computation
|
December 21, 2018
Scalable Electron Correlation Methods. 6. Local Spin-Restricted Open-Shell Second-Order Møller-Plesset Perturbation Theory Using Pair Natural Orbitals: PNO-RMP2
Christine Krause, Hans-Joachim Werner
The Journal of Physical Chemistry. A
|
October 8, 2009
Accurate calculations of intermolecular interaction energies using explicitly correlated coupled cluster wave functions and a dispersion-weighted MP2 method
Oliver Marchetti, Hans-Joachim Werner
The Journal of Chemical Physics
|
May 17, 2011
Explicitly correlated multireference configuration interaction with multiple reference functions: avoided crossings and conical intersections
Toru Shiozaki, Hans-Joachim Werner
Page
of 10