Intermolecular potential energy surface for CS 2 dimer
A new four-dimensional intermolecular potential energy surface for CS 2 dimer is obtained by ab initio calculation of the interaction energies for a range of configurations and center-of-mass separation distances for the first time. The calculations were
|Collections||ANU Research Publications|
|Source:||Journal of Computational Chemistry|
|01_Farrokhpour_Intermolecular_potential_2011.pdf||3.1 MB||Adobe PDF|
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