James R. Cheeseman

A comparison of models for calculating nuclear magnetic resonance shielding tensors

James R. Cheeseman, Gary W. Trucks, Todd A. Keith et al. · The Journal of Chemical Physics · 1996 · 2.3K citations

Properties of atoms in molecules: atomic volumes

Richard F. W. Bader, Marshall T. Carroll, James R. Cheeseman et al. · Journal of the American Chemical Society · 1987 · 1.3K citations

Engineering, Chemical Analysis, Altmetric Attention Score +17

Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical Rotations of Chiral Molecules

Benedetta Mennucci, J. Tomasi, Roberto Cammi et al. · The Journal of Physical Chemistry A · 2002 · 739 citations

Engineering, Organic Chemistry, Computational Chemistry +17

Ab initio calculation of atomic axial tensors and vibrational rotational strengths using density functional theory

James R. Cheeseman, Michael J. Frisch, F. J. Devlin et al. · Chemical Physics Letters · 1996 · 449 citations

Engineering, Physics, Natural Sciences +9

Computational molecular spectroscopy

Vincenzo Barone, Silvia Alessandrini, Małgorzata Biczysko et al. · Nature Reviews Methods Primers · 2021 · 400 citations · Full text

Molecular Spectroscopy, Natural Sciences, Spectroscopy +6