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Note on a theoretical interpretation of the isotopic ratio vOH/vOD versus vOH in isotopically diluted HDO molecules in solid hydrates

1983; Elsevier BV; Volume: 99; Issue: 2 Linguagem: Inglês

10.1016/0009-2614(83)80540-5

1873-4448

Marek Wójcik, Jan Lindgren, Jörgen Tegenfeldt,

Spacecraft and Cryogenic Technologies

A simple intra- and inter-molecular potential for water molecules engaged in hydrogen bonding has been used in a one-dimensional approximation for a theoretical interpretation of the experimental correlation vOH/vOD versus vOH in solid hydrates. The variation in the equilibrium OH(D) distance has also been considered.