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2025-04-17T18:06:06
DS_kk4a8u1eo42m_0
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2025-04-16T20:48:50
DS_kk4a8u1eo42m_0
1
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2025-04-16T17:41:29
DS_kk4a8u1eo42m_0
1
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2025-04-16T18:07:46
DS_kk4a8u1eo42m_0
1
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2025-04-16T18:54:58
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
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2025-04-16T17:13:47
DS_kk4a8u1eo42m_0
1
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2025-04-16T16:08:30
DS_kk4a8u1eo42m_0
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2025-04-16T18:20:07
DS_kk4a8u1eo42m_0
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2025-04-16T17:50:49
DS_kk4a8u1eo42m_0
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2025-04-16T20:15:40
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2025-04-16T21:57:13
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2025-04-17T18:48:22
DS_kk4a8u1eo42m_0
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2025-04-16T16:46:19
DS_kk4a8u1eo42m_0
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DS_kk4a8u1eo42m_0
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2025-04-16T18:47:56
DS_kk4a8u1eo42m_0
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2025-04-16T18:18:40
DS_kk4a8u1eo42m_0
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2025-04-16T21:30:02
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2025-04-17T17:45:49
DS_kk4a8u1eo42m_0
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2025-04-16T17:47:31
DS_kk4a8u1eo42m_0
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2025-04-16T17:21:07
DS_kk4a8u1eo42m_0
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DS_kk4a8u1eo42m_0
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2025-04-16T17:39:46
DS_kk4a8u1eo42m_0
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2025-04-16T21:43:16
DS_kk4a8u1eo42m_0
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2025-04-17T18:26:41
DS_kk4a8u1eo42m_0
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2025-04-16T20:35:24
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2025-04-16T15:43:54
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2025-04-16T15:23:14
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2025-04-16T18:55:55
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2025-04-16T17:29:14
DS_kk4a8u1eo42m_0
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2025-04-16T17:45:49
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2025-04-16T20:33:21
DS_kk4a8u1eo42m_0
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2025-04-16T21:56:50
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2025-04-16T17:32:52
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2025-04-16T18:46:02
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2025-04-16T21:52:07
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2025-04-16T15:18:28
DS_kk4a8u1eo42m_0
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2025-04-16T18:12:11
DS_kk4a8u1eo42m_0
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2025-04-16T22:03:29
DS_kk4a8u1eo42m_0
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2025-04-16T21:09:01
DS_kk4a8u1eo42m_0
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2025-04-16T18:07:53
DS_kk4a8u1eo42m_0
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2025-04-16T18:04:40
DS_kk4a8u1eo42m_0
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2025-04-16T18:47:30
DS_kk4a8u1eo42m_0
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2025-04-16T20:20:36
DS_kk4a8u1eo42m_0
1
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DFT-PBE
-587.916901
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2025-04-16T21:37:17
DS_kk4a8u1eo42m_0
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2025-04-16T17:56:02
DS_kk4a8u1eo42m_0
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2025-04-16T18:52:56
DS_kk4a8u1eo42m_0
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PO_1051295695041786328410349
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2025-04-16T16:23:37
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
DFT-PBE
-133.592661
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2025-04-16T18:10:37
DS_kk4a8u1eo42m_0
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DFT-PBE
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2025-04-16T16:49:41
DS_kk4a8u1eo42m_0
1
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DFT-PBE
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2025-04-16T17:54:22
DS_kk4a8u1eo42m_0
1
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2025-04-16T16:56:51
DS_kk4a8u1eo42m_0
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2025-04-16T21:09:01
DS_kk4a8u1eo42m_0
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2025-04-16T18:21:17
DS_kk4a8u1eo42m_0
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2025-04-16T17:31:20
DS_kk4a8u1eo42m_0
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2025-04-16T18:44:19
DS_kk4a8u1eo42m_0
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2025-04-16T16:57:01
DS_kk4a8u1eo42m_0
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2025-04-16T16:56:16
DS_kk4a8u1eo42m_0
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2025-04-16T20:32:44
DS_kk4a8u1eo42m_0
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2025-04-16T16:24:36
DS_kk4a8u1eo42m_0
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2025-04-16T21:23:51
DS_kk4a8u1eo42m_0
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2025-04-16T21:30:02
DS_kk4a8u1eo42m_0
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2025-04-16T16:45:20
DS_kk4a8u1eo42m_0
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2025-04-16T16:08:27
DS_kk4a8u1eo42m_0
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2025-04-16T21:37:22
DS_kk4a8u1eo42m_0
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2025-04-16T16:04:50
DS_kk4a8u1eo42m_0
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2025-04-16T18:09:37
DS_kk4a8u1eo42m_0
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2025-04-16T18:28:43
DS_kk4a8u1eo42m_0
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2025-04-16T22:03:29
DS_kk4a8u1eo42m_0
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2025-04-17T17:35:57
DS_kk4a8u1eo42m_0
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2025-04-16T20:35:09
DS_kk4a8u1eo42m_0
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2025-04-16T17:44:01
DS_kk4a8u1eo42m_0
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DFT-PBE
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2025-04-16T16:09:54
DS_kk4a8u1eo42m_0
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DFT-PBE
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2025-04-17T18:16:17
DS_kk4a8u1eo42m_0
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CASTEP 6.01
DFT-PBE
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2025-04-16T18:09:08
DS_kk4a8u1eo42m_0
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CASTEP 6.01
DFT-PBE
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2025-04-16T20:48:22
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
DFT-PBE
-11.088201
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2025-04-16T16:34:13
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
DFT-PBE
-127.328566
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2025-04-16T21:28:46
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
DFT-PBE
-131.962208
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2025-04-16T16:03:53
DS_kk4a8u1eo42m_0
1
CASTEP 6.01
DFT-PBE
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