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Author
Hans‐Joachim Werner
also known as H WERNER, H Werner, H-J. Werner
InLeaVe · Brigham Young University · University of Stuttgart · INSEAD
About this author
Works
595
Cited by
61,834
h-index
107
i10
327
ORCID ↗
Top papers
An efficient internally contracted multiconfiguration–reference configuration interaction method
Hans‐Joachim Werner, Peter J. Knowles
·
1988
·
The Journal of Chemical Physics
↗ 3,866
Molpro: a general‐purpose quantum chemistry program package
Hans‐Joachim Werner, Peter J. Knowles, Gerald Knizia, et al.
·
2011
·
Wiley Interdisciplinary Reviews Computational Molecular Science
↗ 3,797
A second order multiconfiguration SCF procedure with optimum convergence
Hans‐Joachim Werner, Peter J. Knowles
·
1985
·
The Journal of Chemical Physics
↗ 3,148
An efficient method for the evaluation of coupling coefficients in configuration interaction calculations
Peter J. Knowles, Hans‐Joachim Werner
·
1988
·
Chemical Physics Letters
↗ 2,849
An efficient second-order MC SCF method for long configuration expansions
Peter J. Knowles, Hans‐Joachim Werner
·
1985
·
Chemical Physics Letters
↗ 2,789
Coupled cluster theory for high spin, open shell reference wave functions
Peter J. Knowles, Claudia Hampel, Hans‐Joachim Werner
·
1993
·
The Journal of Chemical Physics
↗ 2,014
A simple and efficient CCSD(T)-F12 approximation
Thomas B. Adler, Gerald Knizia, Hans‐Joachim Werner
·
2007
·
The Journal of Chemical Physics
↗ 1,983
Simplified CCSD(T)-F12 methods: Theory and benchmarks
Gerald Knizia, Thomas B. Adler, Hans‐Joachim Werner
·
2009
·
The Journal of Chemical Physics
↗ 1,977
A comparison of the efficiency and accuracy of the quadratic configuration interaction (QCISD), coupled cluster (CCSD), and Brueckner coupled cluster (BCCD) methods
Claudia Hampel, Kirk A. Peterson, Hans‐Joachim Werner
·
1992
·
Chemical Physics Letters
↗ 1,633
Systematically convergent basis sets for explicitly correlated wavefunctions: The atoms H, He, B–Ne, and Al–Ar
Kirk A. Peterson, Thomas B. Adler, Hans‐Joachim Werner
·
2008
·
The Journal of Chemical Physics
↗ 1,414
Spin-orbit matrix elements for internally contracted multireference configuration interaction wavefunctions
Andreas Berning, Marcus Schweizer, Hans‐Joachim Werner, et al.
·
2000
·
Molecular Physics
↗ 998
Multireference perturbation theory for large restricted and selected active space reference wave functions
Paolo Celani, Hans‐Joachim Werner
·
2000
·
The Journal of Chemical Physics
↗ 877