Rohini C. Lochan
University of California, Berkeley(US)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Crystallography and molecular interactions, Advanced NMR Techniques and Applications, Metal-Organic Frameworks: Synthesis and Applications
Most-Cited Works
- → Advances in molecular quantum chemistry contained in the Q-Chem 4 program package(2014)3,103 cited
- → Advances in methods and algorithms in a modern quantum chemistry program package(2006)2,783 cited
- → Unravelling the Origin of Intermolecular Interactions Using Absolutely Localized Molecular Orbitals(2007)620 cited
- → Scaled opposite-spin second order Møller–Plesset correlation energy: An economical electronic structure method(2004)564 cited
- → Computational studies of molecular hydrogen binding affinities: The role of dispersion forces, electrostatics, and orbital interactions(2006)539 cited
- → Semiempirical Double-Hybrid Density Functional with Improved Description of Long-Range Correlation(2008)139 cited
- → Scaled Opposite Spin Second Order Møller−Plesset Theory with Improved Physical Description of Long-Range Dispersion Interactions(2005)92 cited
- → Interaction of Molecular Hydrogen with Open Transition Metal Centers for Enhanced Binding in Metal-Organic Frameworks: A Computational Study(2008)50 cited
- → Quartic-Scaling Analytical Energy Gradient of Scaled Opposite-Spin Second-Order Møller−Plesset Perturbation Theory(2007)49 cited
- → Analytical gradient of restricted second-order Møller–Plesset correlation energy with the resolution of the identity approximation, applied to the TCNE dimer anion complex(2006)27 cited