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2025-04-16T16:10:20
DS_aaocsvp2x40m_0
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2025-04-16T16:57:01
DS_aaocsvp2x40m_0
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2025-04-16T17:04:26
DS_aaocsvp2x40m_0
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2025-04-16T18:08:14
DS_aaocsvp2x40m_0
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2025-04-16T16:09:52
DS_aaocsvp2x40m_0
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Ti32
Ti
A
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32
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PO_1000038697712575677939192
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2025-04-16T16:05:52
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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null
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null
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PO_1000071404016098186454003
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2025-04-16T16:07:34
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti12
Ti
A
[ "Ti" ]
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12
1
0
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data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1000356577055754819405452
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2025-04-16T17:44:01
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
[ "Ti" ]
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32
1
0
[ 0, 0, 0 ]
[ "dp_gen" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1000790295349241784683999
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2025-04-16T17:41:42
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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32
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data/MD/5202/MD_1086845055867124744315202.json
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PO_1000771583792555262191333
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2025-04-17T18:06:06
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-229.30777
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Ti32
Ti
A
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32
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PO_1000876083436410075318064
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2025-04-16T19:57:19
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-71.717567
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Ti10
Ti
A
[ "Ti" ]
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10
1
0
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data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1000935634000259175214925
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2025-04-16T16:54:17
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-136.774597
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Ti20
Ti
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2025-04-16T16:22:41
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti12
Ti
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PO_1001155415362936809113167
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2025-04-16T21:13:01
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti16
Ti
A
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16
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PO_1001266458146520237446735
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2025-04-16T19:57:50
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti32
Ti
A
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32
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0
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null
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PO_1001514168811739103773995
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2025-04-16T18:09:37
DS_aaocsvp2x40m_0
1
VASP
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Ti16
Ti
A
[ "Ti" ]
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16
1
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PO_4910829928650403525164789
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2025-04-16T16:52:27
DS_aaocsvp2x40m_0
1
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DFT-PBE
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Ti32
Ti
A
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32
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PO_4902056099263666364576774
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2025-04-16T20:31:48
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-122.494667
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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PO_4912064522984871843399763
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2025-04-16T16:31:50
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
[ "Ti" ]
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null
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null
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PO_4915852924772754130724420
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2025-04-17T18:37:27
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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PO_4919527933992214591160881
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2025-04-16T21:51:00
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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32
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PO_4920862678676497154917915
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2025-04-16T21:23:51
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-241.931198
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[ true, true, true ]
Ti32
Ti
A
[ "Ti" ]
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32
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
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PO_4926618456480850415471654
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2025-04-16T20:53:47
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-120.24395
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Ti16
Ti
A
[ "Ti" ]
[ 1 ]
[ 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22 ]
16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4923635092871690727667820
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2025-04-16T16:46:17
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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32
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PO_4923407862503539770466401
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2025-04-16T17:19:09
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-113.648178
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Ti16
Ti
A
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16
1
0
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null
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PO_4923413688694669698088537
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2025-04-16T16:23:01
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-120.103645
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
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null
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PO_4924544540346436886913896
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2025-04-16T21:22:14
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-150.03125
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Ti20
Ti
A
[ "Ti" ]
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20
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4921787952488576694953610
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2025-04-16T18:24:27
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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2025-04-16T16:29:37
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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PO_4921209018099030692180590
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2025-04-16T16:28:43
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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PO_4938658297952642482800013
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2025-04-16T16:29:31
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
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PO_4938896614380983646287715
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2025-04-16T18:55:36
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1002694341525519109537950
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2025-04-16T17:56:02
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti16
Ti
A
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PO_1002788249502692155835030
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2025-04-16T20:10:41
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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PO_1002870342021902443239408
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2025-04-16T21:13:40
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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PO_1002847520557237525073624
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2025-04-16T17:10:24
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-119.695442
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Ti16
Ti
A
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16
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PO_4937560562222077619841587
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2025-04-16T20:47:06
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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16
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PO_4932899421949100054076849
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2025-04-16T18:27:12
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-236.205811
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Ti32
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PO_1004005981061267330057337
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2025-04-16T17:54:01
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1004227312578809338914257
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2025-04-16T20:12:06
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1004473458908143276445014
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2025-04-16T17:42:29
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
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0
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null
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PO_1004486375960335379762282
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2025-04-16T21:43:16
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1004752252435066265305065
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2025-04-16T21:56:50
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti10
Ti
A
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10
1
0
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PO_1004696002896932719707632
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2025-04-16T16:42:47
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-116.818657
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Ti16
Ti
A
[ "Ti" ]
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16
1
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null
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PO_1004838179755674887078636
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2025-04-16T16:50:24
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
[ "Ti" ]
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32
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1005170787841276035850742
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2025-04-16T16:33:06
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
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PO_1005597887210803481058803
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2025-04-16T18:08:49
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
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A
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2025-04-16T21:56:50
DS_aaocsvp2x40m_0
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Ti12
Ti
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2025-04-16T17:07:04
DS_aaocsvp2x40m_0
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Ti8
Ti
A
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PO_1003521547002719276392750
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2025-04-16T15:23:12
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti32
Ti
A
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2025-04-16T21:56:50
DS_aaocsvp2x40m_0
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2025-04-16T16:02:27
DS_aaocsvp2x40m_0
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2025-04-16T21:14:40
DS_aaocsvp2x40m_0
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2025-04-16T17:57:37
DS_aaocsvp2x40m_0
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2025-04-16T17:41:29
DS_aaocsvp2x40m_0
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Ti16
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PO_1003832338311471554393595
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2025-04-16T17:24:18
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
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PO_1003909536683500972333023
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2025-04-16T17:18:32
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti6
Ti
A
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6
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null
data/MD/5202/MD_1086845055867124744315202.json
null
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PO_1003970060359371336018618
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2025-04-16T16:29:37
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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PO_4948244191894212282467851
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2025-04-16T17:49:49
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti32
Ti
A
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32
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PO_4949419875202686283307089
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2025-04-17T18:26:41
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti12
Ti
A
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PO_4960984573411774793276755
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2025-04-16T16:31:02
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
[ "Ti" ]
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32
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PO_4960957887991643543592100
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2025-04-16T20:10:30
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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PO_4932545008200125519220874
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2025-04-16T15:44:05
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-111.789589
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4932850405126110268397282
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2025-04-16T21:12:08
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-233.751419
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[ true, true, true ]
Ti32
Ti
A
[ "Ti" ]
[ 1 ]
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32
1
0
[ 0, 0, 0 ]
[ "dp_gen" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4932969220210552111097942
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2025-04-16T16:07:25
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-226.217743
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[ true, true, true ]
Ti32
Ti
A
[ "Ti" ]
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32
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
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PO_4941018441999200781832023
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2025-04-16T16:33:06
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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32
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PO_4944049450768802869033996
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2025-04-16T21:37:22
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-110.135124
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Ti16
Ti
A
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16
1
0
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PO_4962802525822902295447061
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2025-04-16T21:29:37
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-112.241241
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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PO_4959182013597124170153992
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2025-04-16T21:30:02
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti12
Ti
A
[ "Ti" ]
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12
1
0
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null
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PO_4968328474618685359499616
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2025-04-16T20:09:21
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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PO_4968022730774294762270273
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2025-04-16T20:19:21
DS_aaocsvp2x40m_0
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Ti32
Ti
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PO_4965295886924811567562851
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2025-04-16T18:22:11
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1005821871237702448403127
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2025-04-16T21:12:08
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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PO_1006116617591987490701062
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2025-04-16T15:43:22
DS_aaocsvp2x40m_0
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VASP
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Ti16
Ti
A
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16
1
0
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PO_1006332133487671456692920
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2025-04-16T21:23:51
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-244.552505
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Ti32
Ti
A
[ "Ti" ]
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32
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
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PO_1006315525607653814672923
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2025-04-17T18:26:41
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
-238.031937
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Ti32
Ti
A
[ "Ti" ]
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32
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
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PO_1006460088532570233902656
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2025-04-16T21:43:16
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti12
Ti
A
[ "Ti" ]
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12
1
0
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null
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PO_4972740143912426496440791
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2025-04-16T21:38:17
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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PO_1008315429382400983906114
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2025-04-16T20:04:52
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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PO_1008359777159370546616095
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2025-04-16T17:19:33
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
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0
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null
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PO_1008406756961007615482084
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2025-04-16T21:57:13
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
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0
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null
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PO_1008523834702409754328443
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2025-04-16T21:43:25
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
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0
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data/MD/5202/MD_1086845055867124744315202.json
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PO_1007321506505416233052935
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2025-04-16T17:52:48
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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2025-04-16T16:33:14
DS_aaocsvp2x40m_0
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DFT-PBE
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2025-04-17T17:45:49
DS_aaocsvp2x40m_0
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2025-04-16T21:38:17
DS_aaocsvp2x40m_0
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2025-04-17T18:16:17
DS_aaocsvp2x40m_0
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Ti32
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2025-04-16T16:01:25
DS_aaocsvp2x40m_0
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Ti16
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A
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2025-04-16T15:23:12
DS_aaocsvp2x40m_0
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Ti32
Ti
A
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PO_1009385003613109509972834
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2025-04-16T17:56:50
DS_aaocsvp2x40m_0
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DFT-PBE
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Ti32
Ti
A
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PO_1009431276066958427022155
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2025-04-16T16:45:20
DS_aaocsvp2x40m_0
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Ti16
Ti
A
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16
1
0
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PO_1009696390672691233765733
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2025-04-16T20:43:32
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti16
Ti
A
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16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1006777399837180119968405
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2025-04-17T18:06:06
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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16
1
0
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1006838372757262163880206
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2025-04-16T19:07:41
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
[ "Ti" ]
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16
1
0
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data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1006860161947620339603337
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2025-04-16T20:08:38
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti20
Ti
A
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PO_1006810721879873097462070
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2025-04-16T21:14:40
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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16
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PO_1006808711403133319442013
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2025-04-16T21:37:22
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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16
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PO_1007059261296315673907467
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2025-04-16T21:43:25
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti16
Ti
A
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PO_1007014060667709349904202
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2025-04-16T21:29:37
DS_aaocsvp2x40m_0
1
VASP
DFT-PBE
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Ti32
Ti
A
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PO_1007180292942158544254723
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2025-04-16T15:43:39
DS_aaocsvp2x40m_0
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VASP
DFT-PBE
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Ti32
Ti
A
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null
data/MD/5202/MD_1086845055867124744315202.json
null
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