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PO_1000609132641470919677621
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2025-04-16T18:47:54
DS_y5m3hunroa7x_0
1
VASP
null
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Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
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null
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null
null
null
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2025-04-16T17:44:01
DS_y5m3hunroa7x_0
1
VASP
null
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AgPd5
AgPd5
A5B
[ "Ag", "Pd" ]
[ 0.16666666666666666, 0.8333333333333334 ]
[ 47, 46, 46, 46, 46, 46 ]
6
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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2025-04-16T18:24:08
DS_y5m3hunroa7x_0
1
VASP
null
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Ag5Pd3
Ag5Pd3
A5B3
[ "Ag", "Pd" ]
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8
2
3
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null
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null
null
null
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PO_1001243155520753311003211
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2025-04-16T21:30:02
DS_y5m3hunroa7x_0
1
VASP
null
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AgPd3
AgPd3
A3B
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2
3
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null
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null
null
null
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PO_4918556375630510854997188
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2025-04-17T18:48:22
DS_y5m3hunroa7x_0
1
VASP
null
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Ag4Pd4
AgPd
AB
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8
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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2025-04-16T16:57:08
DS_y5m3hunroa7x_0
1
VASP
null
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Ag2Pd6
AgPd3
A3B
[ "Ag", "Pd" ]
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8
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4930006601232459840971315
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2025-04-16T16:54:17
DS_y5m3hunroa7x_0
1
VASP
null
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Pd
Pd
A
[ "Pd" ]
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1
1
3
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null
data/MD/6961/MD_9868980965570439630836961.json
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null
null
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PO_1004043460545636287661480
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2025-04-16T20:51:24
DS_y5m3hunroa7x_0
1
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Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
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8
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1004254208408824362675745
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2025-04-16T15:18:29
DS_y5m3hunroa7x_0
1
VASP
null
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Ag7Pd3
Ag7Pd3
A7B3
[ "Ag", "Pd" ]
[ 0.7, 0.3 ]
[ 46, 46, 46, 47, 47, 47, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "bcc_298" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1004331989921966574029232
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2025-04-16T15:45:08
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.211349
0.168597
null
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[ true, true, true ]
Ag2Pd4
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 46, 46, 46, 46, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
[ "fcc_720" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1004321468875190183605620
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2025-04-16T21:52:07
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.237373
0.168045
null
CO_4696092514278525137967046
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[ true, true, true ]
Ag6Pd
Ag6Pd
A6B
[ "Ag", "Pd" ]
[ 0.8571428571428571, 0.14285714285714285 ]
[ 46, 47, 47, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_251" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1004737322377242656006094
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2025-04-16T17:45:08
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.234597
0.086879
null
CO_6552246884645587850005433
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[ true, true, true ]
AgPd7
AgPd7
A7B
[ "Ag", "Pd" ]
[ 0.125, 0.875 ]
[ 46, 46, 46, 46, 46, 46, 46, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_577" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1004859758338351864352944
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2025-04-16T17:58:31
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.218748
0.196039
null
CO_4649988419377968496505205
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_666" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4959302568369826639937721
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2025-04-16T18:45:06
DS_y5m3hunroa7x_0
1
VASP
null
-36.849035
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true
null
null
null
null
null
0.343241
0.15714
null
CO_9571877093625100292523592
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[ true, true, true ]
Ag2Pd6
AgPd3
A3B
[ "Ag", "Pd" ]
[ 0.25, 0.75 ]
[ 46, 46, 46, 46, 46, 46, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_299" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_4965773299089266065049328
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2025-04-16T18:14:48
DS_y5m3hunroa7x_0
1
VASP
null
-39.658044
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true
null
null
null
null
null
0.186813
0.126465
null
CO_1027194137753216016100643
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[ true, true, true ]
Ag3Pd6
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 46, 46, 46, 46, 46, 46, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "fcc_712" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_4932904521032205415785416
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2025-04-16T16:08:30
DS_y5m3hunroa7x_0
1
VASP
null
-32.067618
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true
null
null
null
null
null
0.295602
0.205755
null
CO_3696554830184059577131361
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_351" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4941520935254414846439381
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2025-04-16T16:59:46
DS_y5m3hunroa7x_0
1
VASP
null
-35.443116
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true
null
null
null
null
null
0.174776
0.073643
null
CO_6277226548756694375166438
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[ [ 3.655784, 0, 0 ], [ -3.655784, 3.655784, 3.655784 ], [ 9.13946, -9.13946, 9.13946 ] ]
[ [ 0, 0, 0 ], [ 3.655784, -3.655784, 3.655784 ], [ 5.483676, -5.483676, 5.483676 ], [ -1.827892, 1.827892, 1.827892 ], [ 0, 0, 3.655784 ], [ 3.655784, -3.655784, 7.311568 ], [ 1.827892, -1.827892, 1.827892 ], [ 7.311568, -7.311568, 7.311568 ], [ 1.827892, -1.827892, 5.483676 ], [ 5.483676, -5.483676, 9.13946 ] ]
[ true, true, true ]
Ag4Pd6
Ag2Pd3
A3B2
[ "Ag", "Pd" ]
[ 0.4, 0.6 ]
[ 46, 46, 46, 46, 46, 46, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "bcc_80" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_4942393327616047544422634
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2025-04-16T21:30:02
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag6Pd2
Ag3Pd
A3B
[ "Ag", "Pd" ]
[ 0.75, 0.25 ]
[ 46, 46, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_430" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1005967505784207875314621
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2025-04-16T15:43:44
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag2Pd5
Ag2Pd5
A5B2
[ "Ag", "Pd" ]
[ 0.2857142857142857, 0.7142857142857143 ]
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7
2
3
[ 1, 1, 1 ]
[ "fcc_114" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1006221777893026682838893
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2025-04-16T18:28:20
DS_y5m3hunroa7x_0
1
VASP
null
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null
CO_9987185040771662961923170
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[ true, true, true ]
Ag2Pd4
AgPd2
A2B
[ "Ag", "Pd" ]
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[ 46, 46, 46, 46, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
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null
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null
null
null
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PO_4961589265143293414655556
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2025-04-16T16:30:42
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
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CO_1066145806328645247942320
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[ true, true, true ]
Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
[ 46, 47, 47, 47, 47, 47, 47, 47 ]
8
2
3
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null
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null
null
null
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PO_1008784002862744467732030
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2025-04-16T20:33:21
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
AgPd2
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
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3
2
3
[ 1, 1, 1 ]
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1006803939024253784971978
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2025-04-16T16:57:08
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag2Pd5
Ag2Pd5
A5B2
[ "Ag", "Pd" ]
[ 0.2857142857142857, 0.7142857142857143 ]
[ 46, 46, 46, 46, 46, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_110" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1008185663630795538722728
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2025-04-16T16:07:26
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag3Pd5
Ag3Pd5
A5B3
[ "Ag", "Pd" ]
[ 0.375, 0.625 ]
[ 46, 46, 46, 46, 46, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_584" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4998857917754004323139869
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2025-04-16T20:26:29
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
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null
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CO_9786159770934867085190288
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[ true, true, true ]
Ag6Pd
Ag6Pd
A6B
[ "Ag", "Pd" ]
[ 0.8571428571428571, 0.14285714285714285 ]
[ 46, 47, 47, 47, 47, 47, 47 ]
7
2
3
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1009459247487069412104015
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2025-04-16T18:33:20
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
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CO_7601038138921339453072515
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_391" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1009641384881160867985264
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2025-04-16T16:32:15
DS_y5m3hunroa7x_0
1
VASP
null
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null
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Ag3Pd5
Ag3Pd5
A5B3
[ "Ag", "Pd" ]
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8
2
3
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null
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2025-04-16T16:10:20
DS_y5m3hunroa7x_0
1
VASP
null
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Ag3Pd
Ag3Pd
A3B
[ "Ag", "Pd" ]
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4
2
3
[ 1, 1, 1 ]
[ "relaxed_14" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1011800464414078879651350
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2025-04-16T21:29:37
DS_y5m3hunroa7x_0
1
VASP
null
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Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
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8
2
3
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null
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PO_1010450074777756613541206
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2025-04-16T17:20:02
DS_y5m3hunroa7x_0
1
VASP
null
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Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
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7
2
3
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null
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null
null
null
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PO_1010827777605814417566610
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2025-04-16T17:19:41
DS_y5m3hunroa7x_0
1
VASP
null
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Ag6Pd4
Ag3Pd2
A3B2
[ "Ag", "Pd" ]
[ 0.6, 0.4 ]
[ 46, 46, 46, 46, 47, 47, 47, 47, 47, 47 ]
10
2
3
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null
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null
null
null
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PO_4447250079401005922423796
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2025-04-16T17:41:23
DS_y5m3hunroa7x_0
1
VASP
null
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AgPd5
AgPd5
A5B
[ "Ag", "Pd" ]
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6
2
3
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4458963259316048683807838
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2025-04-16T15:44:22
DS_y5m3hunroa7x_0
1
VASP
null
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Ag4Pd5
Ag4Pd5
A5B4
[ "Ag", "Pd" ]
[ 0.4444444444444444, 0.5555555555555556 ]
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9
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1012815178281077143724066
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2025-04-16T16:29:01
DS_y5m3hunroa7x_0
1
VASP
null
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Ag6Pd4
Ag3Pd2
A3B2
[ "Ag", "Pd" ]
[ 0.6, 0.4 ]
[ 46, 46, 46, 46, 47, 47, 47, 47, 47, 47 ]
10
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1012843923419849278461414
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2025-04-16T18:47:56
DS_y5m3hunroa7x_0
1
VASP
null
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Ag5Pd3
Ag5Pd3
A5B3
[ "Ag", "Pd" ]
[ 0.625, 0.375 ]
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8
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
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PO_1012984374253007755813205
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2025-04-16T17:05:19
DS_y5m3hunroa7x_0
1
VASP
null
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Ag4Pd2
Ag2Pd
A2B
[ "Ag", "Pd" ]
[ 0.6666666666666666, 0.3333333333333333 ]
[ 46, 46, 47, 47, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
[ "fcc_63" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1013225125564503834397238
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2025-04-16T18:36:02
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.206955
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CO_1039057360852004722183873
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[ true, true, true ]
Ag3Pd5
Ag3Pd5
A5B3
[ "Ag", "Pd" ]
[ 0.375, 0.625 ]
[ 46, 46, 46, 46, 46, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1013462057887258534773607
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2025-04-17T18:48:22
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
0.347247
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[ true, true, true ]
Ag6Pd5
Ag6Pd5
A6B5
[ "Ag", "Pd" ]
[ 0.5454545454545454, 0.45454545454545453 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47, 47, 47 ]
11
2
3
[ 1, 1, 1 ]
[ "bcc_493" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1013721235311364398269390
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2025-04-16T21:57:13
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
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[ true, true, true ]
Ag2Pd5
Ag2Pd5
A5B2
[ "Ag", "Pd" ]
[ 0.2857142857142857, 0.7142857142857143 ]
[ 46, 46, 46, 46, 46, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1013800147058622404669991
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2025-04-16T16:30:40
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
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[ true, true, true ]
Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
[ 0.42857142857142855, 0.5714285714285714 ]
[ 46, 46, 46, 46, 47, 47, 47 ]
7
2
3
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1013921840834621434544630
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2025-04-16T21:40:11
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_356" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1014660284546490389363400
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2025-04-16T17:54:28
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
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CO_1078323195486203776956697
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[ true, true, true ]
Ag5Pd2
Ag5Pd2
A5B2
[ "Ag", "Pd" ]
[ 0.7142857142857143, 0.2857142857142857 ]
[ 46, 46, 47, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1050554574569684000671672
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2025-04-16T17:23:23
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.267613
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CO_5247139482919655648257609
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[ true, true, true ]
Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
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8
2
3
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null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1014945969952656505436489
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2025-04-16T19:02:01
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.383202
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[ true, true, true ]
Ag6Pd3
Ag2Pd
A2B
[ "Ag", "Pd" ]
[ 0.6666666666666666, 0.3333333333333333 ]
[ 46, 46, 46, 47, 47, 47, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "bcc_735" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4480976847841135487600998
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2025-04-16T18:34:55
DS_y5m3hunroa7x_0
1
VASP
null
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null
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0.437913
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null
CO_6345228334575096802819085
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[ true, true, true ]
Ag5Pd2
Ag5Pd2
A5B2
[ "Ag", "Pd" ]
[ 0.7142857142857143, 0.2857142857142857 ]
[ 46, 46, 47, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_226" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4498381428906774924695731
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2025-04-16T17:54:01
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
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null
null
0.368438
0.234588
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CO_8391341951865434737987074
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_353" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1015191660695502172421802
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2025-04-16T17:59:53
DS_y5m3hunroa7x_0
1
VASP
null
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null
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CO_3329308492737450542644019
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_387" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1015218546323885252527301
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2025-04-16T16:50:24
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
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null
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CO_2625385311680175534013423
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[ true, true, true ]
Ag2Pd6
AgPd3
A3B
[ "Ag", "Pd" ]
[ 0.25, 0.75 ]
[ 46, 46, 46, 46, 46, 46, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "bcc_674" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4546114375705773059332546
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2025-04-16T16:23:19
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.000263
0.000176
null
CO_6690810084487643131595772
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[ true, true, true ]
Ag2Pd4
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 47, 47, 46, 46, 46, 46 ]
6
2
3
[ 1, 1, 1 ]
[ "relaxed_33" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4548261214562424276338958
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2025-04-16T21:56:50
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.224793
0.132022
null
CO_2826907478455815023840032
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[ true, true, true ]
Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
[ 0.42857142857142855, 0.5714285714285714 ]
[ 46, 46, 46, 46, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_128" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4544190993602134827165168
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2025-04-16T18:26:42
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.344702
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null
CO_7548756729818333279600627
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[ true, true, true ]
Ag3Pd6
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 46, 46, 46, 46, 46, 46, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "fcc_700" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1052431364090862206027670
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2025-04-16T21:29:37
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.341266
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null
CO_3048399511533739631622554
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[ [ 1.9919, 1.9919, 0 ], [ 1.9919, -1.9919, 7.9676 ], [ 3.9838, -3.9838, -3.9838 ] ]
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[ true, true, true ]
Ag2Pd8
AgPd4
A4B
[ "Ag", "Pd" ]
[ 0.2, 0.8 ]
[ 46, 46, 46, 46, 46, 46, 46, 46, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "fcc_56" ]
null
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null
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PO_4532455470791084844391273
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2025-04-16T18:52:13
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag4Pd2
Ag2Pd
A2B
[ "Ag", "Pd" ]
[ 0.6666666666666666, 0.3333333333333333 ]
[ 46, 46, 47, 47, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
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null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1052981768357465423511452
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2025-04-16T17:45:01
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag4Pd2
Ag2Pd
A2B
[ "Ag", "Pd" ]
[ 0.6666666666666666, 0.3333333333333333 ]
[ 46, 46, 47, 47, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
[ "fcc_59" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4558557356907172950870745
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2025-04-16T18:08:14
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
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null
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null
CO_1156647337077835227517838
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[ true, true, true ]
Ag4Pd3
Ag4Pd3
A4B3
[ "Ag", "Pd" ]
[ 0.5714285714285714, 0.42857142857142855 ]
[ 46, 46, 46, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "bcc_222" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1016423549570202662831766
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2025-04-16T20:08:41
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
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0.217738
null
CO_3982645732004259313400544
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[ true, true, true ]
Ag2Pd4
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 46, 46, 46, 46, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
[ "fcc_703" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4571614444173450165601898
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2025-04-16T18:43:29
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
null
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[ true, true, true ]
Ag2Pd4
AgPd2
A2B
[ "Ag", "Pd" ]
[ 0.3333333333333333, 0.6666666666666666 ]
[ 46, 46, 46, 46, 47, 47 ]
6
2
3
[ 1, 1, 1 ]
[ "fcc_706" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1054838383058291170542231
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2025-04-16T18:16:44
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.282345
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null
CO_1047635668720088840770761
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_680" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1016707818576482475172510
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2025-04-16T16:29:57
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
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null
null
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[ true, true, true ]
Ag5Pd5
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "fcc_152" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4575797100159579662173413
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2025-04-16T18:58:19
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
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null
CO_1310839832092323791759006
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[ [ 0, 0, 0 ], [ 2.052125, 0, 2.052125 ], [ 0, 0, 4.10425 ], [ 2.052125, 0, 6.156375 ] ]
[ true, true, true ]
AgPd3
AgPd3
A3B
[ "Ag", "Pd" ]
[ 0.25, 0.75 ]
[ 46, 46, 46, 47 ]
4
2
3
[ 1, 1, 1 ]
[ "fcc_95" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4585166570048209255341269
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2025-04-16T17:08:59
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.380266
0.22174
null
CO_4213862612402681904706460
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[ true, true, true ]
Ag6Pd2
Ag3Pd
A3B
[ "Ag", "Pd" ]
[ 0.75, 0.25 ]
[ 46, 46, 47, 47, 47, 47, 47, 47 ]
8
2
3
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[ "fcc_462" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4569781857907760162378711
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2025-04-16T21:37:22
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
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null
0.173554
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CO_4745621362879552342604784
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[ true, true, true ]
Ag4Pd6
Ag2Pd3
A3B2
[ "Ag", "Pd" ]
[ 0.4, 0.6 ]
[ 46, 46, 46, 46, 46, 46, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "fcc_139" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4557357436175415272659501
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2025-04-17T17:45:49
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.309744
0.241924
null
CO_1126198438901042731273337
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[ true, true, true ]
Ag6Pd2
Ag3Pd
A3B
[ "Ag", "Pd" ]
[ 0.75, 0.25 ]
[ 46, 46, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_556" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4565178472485801714933958
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2025-04-16T16:09:58
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
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null
null
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null
CO_1310489948876562893655963
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[ true, true, true ]
Ag3Pd5
Ag3Pd5
A5B3
[ "Ag", "Pd" ]
[ 0.375, 0.625 ]
[ 46, 46, 46, 46, 46, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_511" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4565231356785717678256277
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2025-04-16T18:16:02
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.433272
0.240758
null
CO_5485169584394499651337489
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[ true, true, true ]
Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
[ 0.42857142857142855, 0.5714285714285714 ]
[ 46, 46, 46, 46, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_173" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4568315559354838512570921
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2025-04-16T20:26:41
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.359957
0.10274
null
CO_3799326140683316215489263
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[ true, true, true ]
Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
[ 46, 47, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_468" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1055900516828372555163229
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2025-04-16T17:20:39
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
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null
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CO_8786585179424721888187799
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[ true, true, true ]
Ag4Pd6
Ag2Pd3
A3B2
[ "Ag", "Pd" ]
[ 0.4, 0.6 ]
[ 46, 46, 46, 46, 46, 46, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "fcc_80" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4588615537843029348651172
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2025-04-16T17:16:57
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.377617
0.230869
null
CO_8309642049095995320805687
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[ true, true, true ]
Ag4Pd3
Ag4Pd3
A4B3
[ "Ag", "Pd" ]
[ 0.5714285714285714, 0.42857142857142855 ]
[ 46, 46, 46, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "bcc_169" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_4596268679704744385056832
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2025-04-16T18:14:35
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.39767
0.212236
null
CO_6326342141335127146499304
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_381" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1017650458591050076201605
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2025-04-17T18:16:17
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.433876
0.229811
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CO_1303907997695501475221061
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Ag6Pd2
Ag3Pd
A3B
[ "Ag", "Pd" ]
[ 0.75, 0.25 ]
[ 46, 46, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_428" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4603267983888400555834541
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2025-04-16T20:22:40
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.003573
0.002101
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[ true, true, true ]
Ag3Pd3
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 47, 47, 47, 46, 46, 46 ]
6
2
3
[ 1, 1, 1 ]
[ "unrelaxed_23" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4612767632242356025025140
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2025-04-16T21:37:17
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
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null
CO_4108185933593257767389784
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[ true, true, true ]
Ag4Pd2
Ag2Pd
A2B
[ "Ag", "Pd" ]
[ 0.6666666666666666, 0.3333333333333333 ]
[ 47, 47, 47, 47, 46, 46 ]
6
2
3
[ 1, 1, 1 ]
[ "relaxed_62" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1017952657371445210569166
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2025-04-16T19:57:50
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.000497
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CO_1123432482231582675503855
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[ true, true, true ]
Ag5Pd
Ag5Pd
A5B
[ "Ag", "Pd" ]
[ 0.8333333333333334, 0.16666666666666666 ]
[ 47, 47, 47, 47, 47, 46 ]
6
2
3
[ 1, 1, 1 ]
[ "relaxed_21" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1057772674663234271729412
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2025-04-16T17:47:31
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
null
null
0.414381
0.207426
null
CO_1244188604665265748713482
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Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_348" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4607834585847097206864540
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2025-04-16T16:56:11
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
null
null
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null
CO_2130723031203819787691340
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_402" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1057980022398377838107530
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2025-04-16T21:22:14
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
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null
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CO_4525534685744798005148447
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Ag4Pd5
Ag4Pd5
A5B4
[ "Ag", "Pd" ]
[ 0.4444444444444444, 0.5555555555555556 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "bcc_697" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1018116625992239651764500
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2025-04-16T16:54:28
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
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null
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null
CO_3696554830184059577131361
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_351" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_4643445107467374918158192
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2025-04-16T18:47:00
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.419822
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null
CO_1157972158918893467248803
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[ true, true, true ]
Ag5Pd5
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
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null
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PO_4645930934813578826124790
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2025-04-16T16:55:31
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag2Pd6
AgPd3
A3B
[ "Ag", "Pd" ]
[ 0.25, 0.75 ]
[ 46, 46, 46, 46, 46, 46, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_288" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4649932544723287686793916
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2025-04-16T17:11:08
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag5Pd3
Ag5Pd3
A5B3
[ "Ag", "Pd" ]
[ 0.625, 0.375 ]
[ 46, 46, 46, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_640" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4650792329732289086925380
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2025-04-16T16:07:46
DS_y5m3hunroa7x_0
1
VASP
null
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null
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[ true, true, true ]
Ag4Pd5
Ag4Pd5
A5B4
[ "Ag", "Pd" ]
[ 0.4444444444444444, 0.5555555555555556 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "fcc_732" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4650021863319752788011179
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2025-04-16T21:38:17
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.246702
0.166526
null
CO_1136430971725875759644850
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[ true, true, true ]
Ag2Pd7
Ag2Pd7
A7B2
[ "Ag", "Pd" ]
[ 0.2222222222222222, 0.7777777777777778 ]
[ 46, 46, 46, 46, 46, 46, 46, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "fcc_20" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1018672301171295883021364
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2025-04-17T18:37:27
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
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0.164284
null
CO_9475268564826578249774490
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_507" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1018758220676601083657218
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2025-04-16T18:22:53
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
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[ true, true, true ]
Ag2Pd7
Ag2Pd7
A7B2
[ "Ag", "Pd" ]
[ 0.2222222222222222, 0.7777777777777778 ]
[ 46, 46, 46, 46, 46, 46, 46, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "fcc_707" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_1058799836939522827692845
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2025-04-16T21:27:46
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
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CO_9404860395377844989914886
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[ true, true, true ]
Ag5Pd5
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 46, 47, 47, 47, 47, 47 ]
10
2
3
[ 1, 1, 1 ]
[ "fcc_196" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1058846089258461593238290
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2025-04-16T16:54:34
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.331896
0.127504
null
CO_5329230381398970056267695
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[ true, true, true ]
Ag5Pd2
Ag5Pd2
A5B2
[ "Ag", "Pd" ]
[ 0.7142857142857143, 0.2857142857142857 ]
[ 46, 46, 47, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "bcc_285" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1059054592944617273007486
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2025-04-16T21:27:46
DS_y5m3hunroa7x_0
1
VASP
null
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CO_3001794395265428649055014
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Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
[ 0.42857142857142855, 0.5714285714285714 ]
[ 46, 46, 46, 46, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_125" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4629713195648698257553083
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2025-04-16T21:23:51
DS_y5m3hunroa7x_0
1
VASP
null
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[ true, true, true ]
Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
[ 46, 47, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_469" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4630243094139044644407912
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2025-04-16T17:44:43
DS_y5m3hunroa7x_0
1
VASP
null
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null
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null
null
null
0.375663
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[ true, true, true ]
Ag5Pd3
Ag5Pd3
A5B3
[ "Ag", "Pd" ]
[ 0.625, 0.375 ]
[ 46, 46, 46, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_592" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4632623361490534579891227
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2025-04-16T16:01:29
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
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null
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CO_2540466830919220336121685
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[ true, true, true ]
Ag5Pd4
Ag5Pd4
A5B4
[ "Ag", "Pd" ]
[ 0.5555555555555556, 0.4444444444444444 ]
[ 46, 46, 46, 46, 47, 47, 47, 47, 47 ]
9
2
3
[ 1, 1, 1 ]
[ "bcc_724" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_1019326035076519882990487
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2025-04-16T18:07:53
DS_y5m3hunroa7x_0
1
VASP
null
-16.059462
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null
null
null
null
null
0.232256
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null
CO_3724786320871638305771863
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[ [ 0, 0, 0 ], [ 2.02475, 0, 2.02475 ], [ 0, 2.02475, 2.02475 ], [ 2.02475, 2.02475, 4.0495 ] ]
[ true, true, true ]
Ag2Pd2
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 47, 47 ]
4
2
3
[ 1, 1, 1 ]
[ "fcc_166" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
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PO_4658577180255408776490868
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2025-04-16T21:12:08
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.26716
0.205635
null
CO_1204090066593254632587738
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[ true, true, true ]
Ag4Pd4
AgPd
AB
[ "Ag", "Pd" ]
[ 0.5, 0.5 ]
[ 46, 46, 46, 46, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "bcc_634" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4666800569410192600597868
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2025-04-16T18:52:09
DS_y5m3hunroa7x_0
1
VASP
null
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null
null
null
null
null
0.000474
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null
CO_5023207369904885136404585
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[ true, true, true ]
AgPd5
AgPd5
A5B
[ "Ag", "Pd" ]
[ 0.16666666666666666, 0.8333333333333334 ]
[ 47, 46, 46, 46, 46, 46 ]
6
2
3
[ 1, 1, 1 ]
[ "relaxed_40" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
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PO_4659722108802199556455741
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2025-04-16T17:55:53
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.239927
0.171957
null
CO_6523030337009486501847583
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[ true, true, true ]
Ag4Pd3
Ag4Pd3
A4B3
[ "Ag", "Pd" ]
[ 0.5714285714285714, 0.42857142857142855 ]
[ 46, 46, 46, 47, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_200" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1060775012196996201179760
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2025-04-16T18:30:46
DS_y5m3hunroa7x_0
1
VASP
null
-18.235403
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true
null
null
null
null
null
0
0
null
CO_1116814678410198999792928
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[ [ 0, 0, 0 ], [ 2.052125, 0, -2.052125 ], [ 0, 2.052125, -2.052125 ], [ 2.052125, 2.052125, 0 ] ]
[ true, true, true ]
AgPd3
AgPd3
A3B
[ "Ag", "Pd" ]
[ 0.25, 0.75 ]
[ 46, 46, 46, 47 ]
4
2
3
[ 1, 1, 1 ]
[ "fcc_111" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1060916731306690905345877
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2025-04-16T17:05:19
DS_y5m3hunroa7x_0
1
VASP
null
-26.857756
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true
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null
null
null
0.221611
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CO_4897580626671449894660579
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[ true, true, true ]
Ag6Pd2
Ag3Pd
A3B
[ "Ag", "Pd" ]
[ 0.75, 0.25 ]
[ 46, 46, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_559" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1061970417924920467325669
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2025-04-16T21:09:01
DS_y5m3hunroa7x_0
1
VASP
null
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true
null
null
null
null
null
0.423636
0.245556
null
CO_1705084530713104668953029
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[ true, true, true ]
Ag5Pd3
Ag5Pd3
A5B3
[ "Ag", "Pd" ]
[ 0.625, 0.375 ]
[ 46, 46, 46, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_368" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1061765387619116474867797
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2025-04-16T21:28:46
DS_y5m3hunroa7x_0
1
VASP
null
-23.812242
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true
null
null
null
null
null
0.255622
0.107251
null
CO_8084599567377862582673330
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[ true, true, true ]
Ag7Pd
Ag7Pd
A7B
[ "Ag", "Pd" ]
[ 0.875, 0.125 ]
[ 46, 47, 47, 47, 47, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_471" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}
PO_1061635469044437572130405
10616354690444375721304051395939253374876083857225386555770752019956741001721567033959136617219200099837191504726198140278989538788007033290981302827374349
2025-04-16T16:05:18
DS_y5m3hunroa7x_0
1
VASP
null
-34.28479
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true
null
null
null
null
null
0.420263
0.20128
null
CO_4352601888353705756154307
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[ true, true, true ]
Ag3Pd5
Ag3Pd5
A5B3
[ "Ag", "Pd" ]
[ 0.375, 0.625 ]
[ 46, 46, 46, 46, 46, 47, 47, 47 ]
8
2
3
[ 1, 1, 1 ]
[ "fcc_309" ]
null
data/MD/5202/MD_1086845055867124744315202.json
null
null
null
{"hash": "10868450558671247443152026947160338505683745266658651051718065983487878962987857602829315249215796444208488632888003673539585986066311769564391053988452926", "id": "MD_1086845055867124744315202"}
PO_4669431805684574345652524
4669431805684574345652524185496746310824625001774221049921082699088822781118803269453512076466554050125763556983823312816767654592389489968369696742916846
2025-04-17T18:26:41
DS_y5m3hunroa7x_0
1
VASP
null
-29.233451
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true
null
null
null
null
null
0.44801
0.252184
null
CO_5028615845385081380258309
5028615845385081380258309799246041816377746506757454155463649273633628981851792828163940733386176322320126960165244936882753523856611564385520729444402598
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[ [ 0, 0, 0 ], [ 2.03257143, 0, -2.03257143 ], [ 4.06514286, 0, 0 ], [ 2.03257143, -2.03257143, 0 ], [ 4.06514286, -2.03257143, -2.03257143 ], [ 2.03257143, -4.06514286, -2.03257143 ], [ 4.06514286, -4.06514286, 0 ] ]
[ true, true, true ]
Ag3Pd4
Ag3Pd4
A4B3
[ "Ag", "Pd" ]
[ 0.42857142857142855, 0.5714285714285714 ]
[ 46, 46, 46, 46, 47, 47, 47 ]
7
2
3
[ 1, 1, 1 ]
[ "fcc_131" ]
null
data/MD/6961/MD_9868980965570439630836961.json
null
null
null
{"input": {"ediff": "1e-8", "prec": "Accurate"}, "hash": "986898096557043963083696129270425589068521386739011243346773571457759533053153368645584486873523744016987353154098266572129140844992330297631317792680405", "id": "MD_9868980965570439630836961"}