articleTop 1% cited
An efficient method for the evaluation of coupling coefficients in configuration interaction calculations
Chemical Physics Letters · 1988 · Vol. 145(6) · pp. 514–522
Peter J. Knowles✉(University of Cambridge)Hans‐Joachim Werner(Bielefeld University)
Solid-state spectroscopy and crystallographyAdvanced Chemical Physics StudiesInorganic Fluorides and Related CompoundsConfiguration interactionMultireference configuration interactionCoupling (piping)Simple (philosophy)Full configuration interactionComputational chemistryChemistryAtomic physicsPhysicsMaterials science
Funding
- Eli Lilly and Company
Citations
2,838
FWCI
23.08
field-weighted impact
References
17
Percentile
100%
vs. same field & year
Citations per year
Cited by
Third-order multireference perturbation theory The CASPT3 method
Molecular Physics · 1996 · 633 citations
Ab Initio Multiple Spawning: Photochemistry from First Principles Quantum Molecular Dynamics
The Journal of Physical Chemistry A · 2000 · 833 citations
Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac–Hartree–Fock data
Chemical Physics · 2004 · 968 citations
An efficient internally contracted multiconfiguration–reference configuration interaction method
The Journal of Chemical Physics · 1988 · 3,850 citations
Gaussian basis sets for use in correlated molecular calculations. III. The atoms aluminum through argon
The Journal of Chemical Physics · 1993 · 9,415 citations
Combining long-range configuration interaction with short-range density functionals
Chemical Physics Letters · 1997 · 774 citations
Spin-orbit matrix elements for internally contracted multireference configuration interaction wavefunctions
Molecular Physics · 2000 · 989 citations
References
Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements
Journal of the American Chemical Society · 1980 · 3,850 citations
Citation Network
How this paper connects to the literature. Drag to explore, click any node to open that paper.