GFN-xTB_JCIM_2021
收藏DataCite Commons2024-03-28 更新2025-04-09 收录
下载链接:
https://materials.colabfit.org/id/DS_0x8ozlt9g3y5_0
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资源简介:
10,000 configurations of organosilicon compounds with energies predicted by an improved GFN-xTB Hamiltonian parameterization, using revPBE.
提供机构:
ColabFit
创建时间:
2024-03-28



