PES15k potential energy surface from High-accuracy water potential energy surface for the calculation of infrared spectra.
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下载链接：
https://rs.figshare.com/articles/dataset/PES15k_potential_energy_surface_from_High-accuracy_water_potential_energy_surface_for_the_calculation_of_infrared_spectra/5759709
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资源简介：
Fortran program for the PES15k potential
提供机构：
The Royal Society
创建时间：
2018-01-05
