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Автор K F O'Sullivan
Автор P A Madden
Дата выпуска 1991-11-04
dc.description Molecular dynamics computer simulations with shell-model potentials have been used to calculate the light scattering (Raman) spectra of molten LiCl. A significant improvement in the level of agreement with experiment is found over previous simulations with rigid-ion potentials. The improvement is attributed to the better description of the relaxation of the charge-density fluctuations in the shell-model simulations.
Формат application.pdf
Издатель Institute of Physics Publishing
Название Light scattering by alkali halides melts: a comparison of shell-model and rigid-ion computer simulation results
Тип paper
DOI 10.1088/0953-8984/3/44/018
Electronic ISSN 1361-648X
Print ISSN 0953-8984
Журнал Journal of Physics: Condensed Matter
Том 3
Первая страница 8751
Последняя страница 8756
Аффилиация K F O'Sullivan; Phys. Chem. Lab., Oxford Univ., UK
Аффилиация P A Madden; Phys. Chem. Lab., Oxford Univ., UK
Выпуск 44

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