Spectral data for each snapshot
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下载链接:
https://figshare.com/articles/dataset/Spectral_data_for_each_snapshot/5028848
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资源简介:
Here are four archives with raw data extracted from the log-files of PE-EFF-B3LYP/pcseg-2 calculations.
m1: (+)-isoterrein
m2: (-)-terrein
m3: (+)-isoterrein
m4: (-)-terrein
The snapshots are numbered according to the following (not so obvious scheme):
Files within the archives that are:
ending in *0.dat are extracted at 500ns
ending in *9.dat are extracted at 1000 ns
ending in *8.dat are extracted at 1500 ns
ending in *7.dat are extracted at 2000 ns
ending in *6.dat are extracted at 1250 ns
ending in *5.dat are extracted at 1750 ns
创建时间:
2017-05-25



