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{
"id": "jvasp-16013",
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{
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{
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"structure_string": "Si4 P8\n1.0\n5.783281 -0.000000 -0.000000\n0.000000 5.783281 0.000000\n0.000000 0.000000 5.783281\nSi P\n4 8\ndirect\n0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.500000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.608707 0.608707 0.608707 P\n0.891293 0.391293 0.108707 P\n0.108707 0.891293 0.391293 P\n0.391293 0.108707 0.891293 P\n0.608707 0.891293 0.108707 P\n0.891293 0.108707 0.608707 P\n0.108707 0.608707 0.891293 P\n0.391293 0.391293 0.391293 P\n",
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{
"id": "jvasp-152",
"created_at": "2022-09-04T14:38:09.259287Z",
"updated_at": "2022-09-04T14:38:09.259310Z",
"structure_string": "Si8 P16\n1.0\n3.479872 0.000000 0.000000\n0.000000 9.945997 0.000000\n0.000000 0.000000 14.479183\nSi P\n8 16\ndirect\n0.000000 0.589442 0.852555 Si\n0.000000 0.410559 0.147445 Si\n0.000000 0.089442 0.647445 Si\n0.000000 0.910559 0.352555 Si\n0.500000 0.806640 0.733784 Si\n0.500000 0.193360 0.266216 Si\n0.500000 0.306640 0.766216 Si\n0.500000 0.693360 0.233784 Si\n0.500000 0.047249 0.388408 P\n0.500000 0.952751 0.611592 P\n0.500000 0.610612 0.386886 P\n0.500000 0.389388 0.613114 P\n0.500000 0.110612 0.113114 P\n0.500000 0.889388 0.886886 P\n0.000000 0.728628 0.450663 P\n0.000000 0.834823 0.204387 P\n0.000000 0.228628 0.049337 P\n0.000000 0.771372 0.950663 P\n0.500000 0.452751 0.888408 P\n0.000000 0.165177 0.795613 P\n0.000000 0.334823 0.295613 P\n0.000000 0.665177 0.704387 P\n0.000000 0.271372 0.549337 P\n0.500000 0.547250 0.111592 P\n",
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"volume": 501.13605589940244,
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"formula_full": "Si8 P16",
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{
"id": "jvasp-123618",
"created_at": "2022-09-04T14:38:52.242118Z",
"updated_at": "2022-09-04T14:38:52.242143Z",
"structure_string": "Si1 P3\n1.0\n3.280116 0.000000 -1.050334\n0.049084 4.116736 0.153286\n-0.035926 0.188632 5.534750\nSi P\n1 3\ndirect\n0.395047 0.942750 0.790100 Si\n0.611337 0.060408 0.222672 P\n0.102110 0.420283 0.204221 P\n0.891503 0.576561 0.783009 P\n",
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"elements": [
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},
{
"id": "jvasp-79533",
"created_at": "2022-09-04T14:37:13.050483Z",
"updated_at": "2022-09-04T14:37:13.050509Z",
"structure_string": "Zn1 Si1 P2\n1.0\n-3.159515 -3.159515 0.000000\n-3.159515 0.000000 -3.159515\n-0.000000 -3.159515 -3.159515\nZn Si P\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499999 0.499999 0.499999 Si\n0.250000 0.250000 0.250000 P\n0.749999 0.749999 0.749999 P\n",
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"elements": [
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"volume": 63.079938363637815,
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"formula_anonymous": "ABC2",
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{
"id": "jvasp-2376",
"created_at": "2022-09-04T14:36:55.765701Z",
"updated_at": "2022-09-04T14:36:55.765711Z",
"structure_string": "Zn2 Si2 P4\n1.0\n4.934051 0.000000 -2.266816\n-1.041427 4.822892 -2.266816\n0.012167 0.015075 6.529726\nZn Si P\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.250000 0.749999 0.499999 Zn\n0.500000 0.500000 -0.000001 Si\n0.750000 0.249999 0.499999 Si\n0.391923 0.375000 0.249999 P\n0.858076 0.874999 0.249999 P\n0.125000 0.608076 0.750000 P\n0.625000 0.141923 0.750000 P\n",
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"formula_full": "Zn2 Si2 P4",
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"spacegroup": 122
},
{
"id": "jvasp-39045",
"created_at": "2022-09-04T14:38:07.688169Z",
"updated_at": "2022-09-04T14:38:07.688196Z",
"structure_string": "Sm1 P3\n1.0\n-1.984531 1.984531 4.871935\n1.984531 -1.984531 4.871935\n1.984531 1.984531 -4.871935\nSm P\n1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.750000 0.250000 0.500001 P\n0.250000 0.750000 0.500001 P\n0.500000 0.500000 0.000000 P\n",
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},
{
"id": "jvasp-10577",
"created_at": "2022-09-04T14:37:19.861963Z",
"updated_at": "2022-09-04T14:37:19.861988Z",
"structure_string": "Sm2 P10\n1.0\n0.000000 4.993731 0.023845\n9.568682 0.000000 0.000000\n0.000000 -1.158389 -5.320279\nSm P\n2 10\ndirect\n0.988506 0.250000 0.649854 Sm\n0.011493 0.750000 0.350145 Sm\n0.718410 0.250000 0.100739 P\n0.281589 0.750000 0.899260 P\n0.382334 0.408756 0.043693 P\n0.617665 0.908756 0.956306 P\n0.617665 0.591244 0.956306 P\n0.382334 0.091244 0.043693 P\n0.287876 0.468994 0.402303 P\n0.712123 0.968994 0.597697 P\n0.712123 0.531006 0.597697 P\n0.287876 0.031006 0.402303 P\n",
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{
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"structure_string": "Sm1 P3\n1.0\n3.541328 -0.000000 -1.133977\n-0.042576 4.086468 -0.132962\n-0.139509 -0.201565 5.660962\nSm P\n1 3\ndirect\n0.338755 -0.017970 0.677511 Sm\n0.620630 0.078300 0.241258 P\n0.122261 0.442185 0.244522 P\n0.918353 0.497488 0.836707 P\n",
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},
{
"id": "jvasp-18945",
"created_at": "2022-09-04T14:35:44.618956Z",
"updated_at": "2022-09-04T14:35:44.618984Z",
"structure_string": "Sm1 P1\n1.0\n3.554529 0.000000 2.052208\n1.184843 3.351241 2.052208\n0.000000 0.000000 4.104416\nSm P\n1 1\ndirect\n0.500000 0.500000 0.500001 Sm\n0.000000 0.000000 0.000000 P\n",
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{
"id": "jvasp-11371",
"created_at": "2022-09-04T14:36:48.655241Z",
"updated_at": "2022-09-04T14:36:48.655266Z",
"structure_string": "Sm2 Zn6 P6\n1.0\n2.016775 -3.493157 -0.000000\n2.016775 3.493157 -0.000000\n-0.000000 0.000000 20.041530\nSm Zn P\n2 6 6\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.666666 0.333332 0.750000 Zn\n0.333332 0.666666 0.250000 Zn\n0.666666 0.333332 0.371276 Zn\n0.333332 0.666666 0.871276 Zn\n0.333332 0.666666 0.628724 Zn\n0.666666 0.333332 0.128724 Zn\n0.666666 0.333332 0.250000 P\n0.333332 0.666666 0.750000 P\n0.333332 0.666666 0.414274 P\n0.666666 0.333332 0.914274 P\n0.666666 0.333332 0.585727 P\n0.333332 0.666666 0.085727 P\n",
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"formula_anonymous": "AB3C3",
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