eginer
|
429b6f404d
|
re-added Large_core
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2019-03-28 15:06:14 +01:00 |
|
Emmanuel Giner
|
99487da7ac
|
extracted data for Small core CC/HF G09
|
2019-03-28 00:27:01 +01:00 |
|
Emmanuel Giner
|
afbbf3f1bc
|
added Small core data CC
|
2019-03-28 00:25:00 +01:00 |
|
Emmanuel Giner
|
1ceb42d8bf
|
moved the Large_core data in an other folder
|
2019-03-27 13:39:18 +01:00 |
|
|
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5715e3de12
|
atoms for small cores
|
2019-03-27 13:22:37 +01:00 |
|
Emmanuel Giner
|
f1e4015e88
|
produced total energies in vdz and vtz for g09
|
2019-03-27 11:46:26 +01:00 |
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|
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e3dced28a5
|
CCSD(T)
|
2019-03-27 11:25:55 +01:00 |
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