five

Bilayers of graphenylenes and octafunctionalized-biphenylenes

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Mendeley Data2024-06-25 更新2024-06-30 收录
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资源简介:
Using Greenwood (a Clojure library), DFTB+, and R these files can completely reproduce input files, gather the results, and perform our analysis on bilayers of graphene, graphenylene, net-C, Type-2, and net-W. The DFTB+ input files are easily recreated, but running the calculations take considerable time to run. Thus, the intermediate results and post-processing results of the calculations are also provided.
创建时间:
2024-01-23
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