Infrared spectroscopic studies of partially deuterated ethanes and the r0, r, and r structures

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

R. Ditchfield, Warren J. Hehre, John A. Pople · The Journal of Chemical Physics · 1971 · 10.5K citations

Natural Sciences, Chemistry, Physics +15

Calculation of inertia defect

Takeshi Oka, Yonezo Morino · Journal of Molecular Spectroscopy · 1961 · 303 citations

Natural Sciences, Physics, Mechanical Behavior Of Materials +1

Comparison of Molecular Structures Determined by Electron Diffraction and Spectroscopy. Ethane and Diborane

K. Kuchitsu · The Journal of Chemical Physics · 1968 · 246 citations · Full text

Natural Sciences, Chemistry, Physics +17

The ground-state average and equilibrium structures of formaldehyde and ethylene

J.L. Duncan · Molecular Physics · 1974 · 228 citations

Natural Sciences, Chemistry, Physics +14

Influence of Vibrations on Molecular Structure Determinations. III. Inertial Defects

D. R. Herschbach, Victor W. Laurie · The Journal of Chemical Physics · 1964 · 209 citations

Natural Sciences, Chemistry, Physics +17