Publication Abstracts
Green 1977
, 1977: Comment on fitting ab initio intermolecular potentials for scattering calculations. J. Chem. Phys., 67, 715-717, doi:10.1063/1.434877.
The angular dependence of the interaction between two rigid linear rotors is considered, and on of the two expansions in current use is shwn to be inappropriate. Interpolation of tabulated radial interactions is also discussed, and nuimerical tests are presented which demonstrate the accuracy of Lagrange and spline algorithms as a function of the spacing between points.
Export citation: [ BibTeX ] [ RIS ]
BibTeX Citation
@article{gr07500u, author={Green, S.}, title={Comment on fitting ab initio intermolecular potentials for scattering calculations}, year={1977}, journal={Journal of Chemical Physics}, volume={67}, pages={715--717}, doi={10.1063/1.434877}, }
[ Close ]
RIS Citation
TY - JOUR ID - gr07500u AU - Green, S. PY - 1977 TI - Comment on fitting ab initio intermolecular potentials for scattering calculations JA - J. Chem. Phys. JO - Journal of Chemical Physics VL - 67 SP - 715 EP - 717 DO - 10.1063/1.434877 ER -
[ Close ]