遇见数据集

Optimized Cartesian coordinates of clusters of the gas phase solvated ferrous ion in methanol

收藏
NIAID Data Ecosystem2026-03-13 收录
官方服务:

资源简介:

These data are optimized Cartesian coordinates of clusters of solvated ferrous ion in methanol. Coordinates are given for the various isomers of each cluster size from n=1 to n=10. All the optimisations were performed in the gas phase at the MP2/6-31++G(d,p) level of theory.

创建时间:
2022-06-14
二维码
社区交流群
二维码
科研交流群
商业服务