Anthony P. Scott

Harmonic Vibrational Frequencies:  An Evaluation of Hartree−Fock, Møller−Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors

Anthony P. Scott, Leo Radom · The Journal of Physical Chemistry · 1996 · 6.6K citations

Spectral Theory, Engineering, Scaling Factors +16

Scaling Factors for Obtaining Fundamental Vibrational Frequencies and Zero‐Point Energies from HF/6–31G* and MP2/6–31G* Harmonic Frequencies

John A. Pople, Anthony P. Scott, Ming Wah Wong et al. · Israel Journal of Chemistry · 1993 · 807 citations

Mp2 Fundamental Frequencies, Engineering, Harmonic Frequencies +17

Fulvalenes, Fulvenes, and Related Molecules:  An ab Initio Study

Anthony P. Scott, Israel Agranat, P. Ulrich Biedermann et al. · The Journal of Organic Chemistry · 1997 · 113 citations

Engineering, Nonplanar Conformations, Heterocyclic +9

The Wolff Rearrangement: The Relevant Portion of the Oxirene-Ketene Potential Energy Hypersurface

Anthony P. Scott, Ross H. Nobes, Henry F. Schaefer et al. · Journal of the American Chemical Society · 1994 · 77 citations

Chemical Engineering, Molecular Sciences, Engineering +14

Singlet−Triplet Splittings and Barriers to Wolff Rearrangement for Carbonyl Carbenes

Anthony P. Scott, Matthew S. Platz, Leo Radom · Journal of the American Chemical Society · 2001 · 69 citations

Halogenation, Chemical Engineering, Engineering +14