Rate constants for ion pair formation an
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Omar A. Karim; J.Andrew McCammon
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Article
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1986
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Elsevier Science
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English
β 520 KB
The reactive flux time correlation function for an associating ion pair in water is obtained by computer simulation. The transmission coeficieht is found directly frond the reactive flux and also through the method of absorbing barriers. Rate constants for the transitions between the contact and sol