The structure of liquid bromine

摘要: The atom-atom correlation function for liquid bromine, derived from the X-ray diffraction studies reported in preceding paper, is compared with results of Monte Carlo computer simulations and reference site interaction model (RISM) calculations various bromine-like molecules. models used included two-centre Lennard-Jones model, both by itself idealized point quadrupole quadrupole-induced dipole terms simulations, two three-centre hard-sphere RISM. None these lead to functions which are good agreement that obtained experiment. This suggests additional information about interactions between bromine molecules will be needed before structure can completely understood. Finally, comparing our RISM analogous models, we obtain some insight into accuracy intera...