(Q57402455)

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MORATE: a program for direct dynamics calculations of chemical reaction rates by semiempirical molecular orbital theory

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MORATE: a program for direct dynamics calculations of chemical reaction rates by semiempirical molecular orbital theory (English)
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Thanh N. Truong
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Da-hong Lu
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Gillian C. Lynch
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Yi-Ping Liu
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Vasilios S. Melissas
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James J.P. Stewart
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Rozeanne Steckler
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Bruce C. Garrett
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Alan D. Isaacson
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Angels Gonzalez-Lafont
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Sachchida N. Rai
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Gene C. Hancock
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Tomi Joseph
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April 1993
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75
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1-2
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143-159
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