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- W2058007213 abstract "A modification of the Porter—Karplus potential-energy surface for H3 is formulated in which maximum use is made of diatomic potential-energy functions for both H2 and H2+. In this formulation, the classical barrier height is found to vary by several kilocalories when scaling functions are altered slightly or when three-center integrals are ignored. Results are compared with several other semiempirical surfaces and with presently available a priori calculations." @default.
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- W2058007213 title "Modified Semiempirical Approach to the H3 Potential-Energy Surface" @default.
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- W2058007213 doi "https://doi.org/10.1063/1.1701693" @default.
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