Ron Shepard
Argonne National Laboratory(US)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Matrix Theory and Algorithms, Machine Learning in Materials Science, Molecular Junctions and Nanostructures
Most-Cited Works
- → Search for stationary points on surfaces(1985)827 cited
- → Multiconfiguration Self-Consistent Field and Multireference Configuration Interaction Methods and Applications(2011)718 cited
- → High-level multireference methods in the quantum-chemistry program system COLUMBUS: Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin–orbit CI and parallel CI density(2001)429 cited
- → A progress report on the status of the COLUMBUSMRCI program system(1988)358 cited
- → The Multiconfiguration Self‐Consistent Field Method(1987)323 cited
- → Analytic evaluation of nonadiabatic coupling terms at the MR-CI level. I. Formalism(2004)311 cited
- → The OpenMolcas Web : A Community-Driven Approach to Advancing Computational Chemistry