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Research Output

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Letter
2009

Efficient approach to reactive molecular dynamics with accurate forces

Higashi, M. & Truhlar, D. G., Nov 1 2009, In : Journal of Chemical Theory and Computation. 5, 11, p. 2925-2929 5 p.

Research output: Contribution to journalLetter

16 Scopus citations
1998

Explanation of deuterium and muonium kinetic isotope effects for hydrogen atom addition to an olefin [9]

Villa, J., Corchado, J. C., Gonzalez-Lafont, A., Lluch, J. M. & Truhlar, D. G., Nov 25 1998, In : Journal of the American Chemical Society. 120, 46, p. 12141-12142 2 p.

Research output: Contribution to journalLetter

20 Scopus citations
1976

Tests of INDO/1s and INDOXI/1s methods for the calculation of the static potential for electron scattering by CO

Truhlar, D. G. & Van-Catledge, F. A., Dec 15 1976, In : Journal of Chemical Physics. 65, 12, p. 5536-5538 3 p.

Research output: Contribution to journalLetter

6 Scopus citations
1973
10 Scopus citations

Multiple potential energy surfaces for reactions of species in degenerate electronic states

Truhlar, D. G., Jan 1 1972, In : The Journal of chemical physics. 56, 6, p. 3189-3190 2 p.

Research output: Contribution to journalLetter

159 Scopus citations
1970

Quantum mechanics of the H +H2 reaction: Exact scattering probabilities for collinear collisions

Truhlar, D. G. & Kuppermann, A., Jan 1 1970, In : The Journal of chemical physics. 52, 7, p. 3841-3843 3 p.

Research output: Contribution to journalLetter

142 Scopus citations