An ab initio potential energy surface for the study of rotationally inelastic OH-H collisions
The Journal of Chemical Physics, ISSN: 0021-9606, Vol: 99, Issue: 5, Page: 3836-3846
1993
- 30Citations
- 2Captures
Metric Options: Counts1 Year3 YearSelecting the 1-year or 3-year option will change the metrics count to percentiles, illustrating how an article or review compares to other articles or reviews within the selected time period in the same journal. Selecting the 1-year option compares the metrics against other articles/reviews that were also published in the same calendar year. Selecting the 3-year option compares the metrics against other articles/reviews that were also published in the same calendar year plus the two years prior.
Example: if you select the 1-year option for an article published in 2019 and a metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019. If you select the 3-year option for the same article published in 2019 and the metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019, 2018 and 2017.
Citation Benchmarking is provided by Scopus and SciVal and is different from the metrics context provided by PlumX Metrics.
Example: if you select the 1-year option for an article published in 2019 and a metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019. If you select the 3-year option for the same article published in 2019 and the metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019, 2018 and 2017.
Citation Benchmarking is provided by Scopus and SciVal and is different from the metrics context provided by PlumX Metrics.
Article Description
A new two-configuration self-consistent field (SCF) plus dispersion potential for the interaction of OH with H is presented. The ground state of OH is a Π state leading to a two component potential which is diagonal in the adiabatic electronic basis in which the quantum chemical calculations are done. The transformation between the adiabatic basis and the electronic basis used in collision calculations is described. The transformed potential matrix is Hermitian in this electronic basis when OH-H configurations with no plane of symmetry are considered. The orientation dependence of the elements of the potential matrix is given in the form of a spherical expansion and the results are compared with previous potential calculations. The comparison is discussed in terms of the dependence on the orientation of the H molecule. © 1993 American Institute of Physics.
Bibliographic Details
Provide Feedback
Have ideas for a new metric? Would you like to see something else here?Let us know