Datasets:
colabfit
/
COMP6v2-wB97X-631Gd

Dataset card Data Studio Files
xet
Community
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property_id
string
property_hash
string
last_modified
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elements
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2025-04-16T18:46:47
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
-17,094.008341
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/0219/MD_1216031544861774870800219.json
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2025-04-16T17:13:47
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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2025-04-16T18:33:20
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/0661/MD_2844360920980315586670661.json
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2025-04-16T20:14:25
DS_15m7etw1om8a_0
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Gaussian 09
DFT-wB97X
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DS_15m7etw1om8a_0
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2025-04-17T18:26:41
DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-16T16:47:21
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-16T18:52:40
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2025-04-16T20:49:43
DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-17T18:26:41
DS_15m7etw1om8a_0
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/0999/MD_1083595655436170396100999.json
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PO_1001843278277342213072795
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2025-04-16T16:49:48
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/8912/MD_7955483353797942627178912.json
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PO_1001884250618337981166821
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2025-04-16T16:31:58
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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PO_1001803355348399679109464
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2025-04-16T17:28:31
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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2025-04-16T21:29:37
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
-22,057.344709
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2025-04-16T21:29:37
DS_15m7etw1om8a_0
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2025-04-16T20:09:39
DS_15m7etw1om8a_0
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2025-04-16T21:12:08
DS_15m7etw1om8a_0
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2025-04-16T17:29:14
DS_15m7etw1om8a_0
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DFT-wB97X
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2025-04-16T15:44:05
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
-33,901.591302
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2025-04-16T17:48:04
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2025-04-16T21:22:14
DS_15m7etw1om8a_0
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2025-04-16T17:41:26
DS_15m7etw1om8a_0
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2025-04-16T20:21:52
DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-16T18:16:44
DS_15m7etw1om8a_0
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2025-04-16T16:26:57
DS_15m7etw1om8a_0
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2025-04-16T18:40:27
DS_15m7etw1om8a_0
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2025-04-16T18:08:14
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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2025-04-16T20:45:40
DS_15m7etw1om8a_0
1
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2025-04-16T15:45:08
DS_15m7etw1om8a_0
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Gaussian 09
DFT-wB97X
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2025-04-16T18:08:39
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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2025-04-16T16:07:34
DS_15m7etw1om8a_0
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2025-04-16T22:04:30
DS_15m7etw1om8a_0
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2025-04-16T16:09:56
DS_15m7etw1om8a_0
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2025-04-16T20:11:54
DS_15m7etw1om8a_0
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Gaussian 09
DFT-wB97X
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DS_15m7etw1om8a_0
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2025-04-16T16:26:23
DS_15m7etw1om8a_0
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2025-04-16T21:14:40
DS_15m7etw1om8a_0
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2025-04-16T21:13:01
DS_15m7etw1om8a_0
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/2046/MD_1153568661412662667492046.json
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2025-04-16T16:20:57
DS_15m7etw1om8a_0
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Gaussian 09
DFT-wB97X
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2025-04-16T21:30:02
DS_15m7etw1om8a_0
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2025-04-16T21:51:00
DS_15m7etw1om8a_0
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2025-04-16T16:55:27
DS_15m7etw1om8a_0
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Gaussian 09
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2025-04-16T21:29:37
DS_15m7etw1om8a_0
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2025-04-17T18:26:41
DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-17T17:35:57
DS_15m7etw1om8a_0
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2025-04-16T18:28:20
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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2025-04-16T17:30:41
DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-16T16:31:56
DS_15m7etw1om8a_0
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C6H9ClO2S2
C6ClH9O2S2
A9B6C2D2E
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2025-04-17T18:06:06
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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C6H12ClNO2
C6ClH12NO2
A12B6C2DE
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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DS_15m7etw1om8a_0
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2025-04-16T20:38:42
DS_15m7etw1om8a_0
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2025-04-16T21:44:51
DS_15m7etw1om8a_0
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2025-04-16T18:41:17
DS_15m7etw1om8a_0
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2025-04-16T19:49:42
DS_15m7etw1om8a_0
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/7674/MD_1008691873655533301037674.json
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2025-04-16T17:50:49
DS_15m7etw1om8a_0
1
Gaussian 09
DFT-wB97X
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DS_15m7etw1om8a_0
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2025-04-16T16:20:54
DS_15m7etw1om8a_0
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2025-04-16T16:23:37
DS_15m7etw1om8a_0
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DFT-wB97X
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2025-04-16T17:57:27
DS_15m7etw1om8a_0
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data/MD/3206/MD_6880008875115372829943206.json
data/MD/8705/MD_9835406223820340695708705.json
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