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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4461",
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{
"id": "jvasp-16828",
"created_at": "2022-09-04T14:38:02.190302Z",
"updated_at": "2022-09-04T14:38:02.190332Z",
"structure_string": "Th2 Pt2\n1.0\n3.723587 0.000000 -1.309467\n-0.000000 4.489288 0.000000\n0.008375 0.000000 5.972724\nTh Pt\n2 2\ndirect\n0.136356 0.750000 0.272711 Th\n0.863644 0.250000 0.727287 Th\n0.403230 0.750000 0.806462 Pt\n0.596769 0.250000 0.193537 Pt\n",
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{
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"updated_at": "2022-09-04T14:38:01.272479Z",
"structure_string": "Yb1 Th1 Pt2\n1.0\n0.000000 3.543602 3.543602\n3.543602 0.000000 3.543602\n3.543602 3.543602 -0.000000\nYb Th Pt\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Yb\n0.250000 0.250000 0.250000 Th\n0.000000 0.000000 0.000000 Pt\n0.500001 0.500001 0.500001 Pt\n",
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{
"id": "jvasp-16738",
"created_at": "2022-09-04T14:37:58.711010Z",
"updated_at": "2022-09-04T14:37:58.711037Z",
"structure_string": "Ti1 Pt3\n1.0\n3.949618 -0.000000 -0.000000\n-0.000000 3.949618 -0.000000\n0.000000 0.000000 3.949618\nTi Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
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"elements": [
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"volume": 61.61199626414366,
"volume_molar": 9.275902850181684,
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"spacegroup": 221
},
{
"id": "jvasp-14506",
"created_at": "2022-09-04T14:37:27.021956Z",
"updated_at": "2022-09-04T14:37:27.021965Z",
"structure_string": "Ti6 Pt2\n1.0\n5.028443 -0.000000 0.000000\n0.000000 5.028443 0.000000\n0.000000 0.000000 5.028443\nTi Pt\n6 2\ndirect\n0.000000 0.250000 0.500000 Ti\n0.000000 0.749999 0.500000 Ti\n0.250000 0.500000 0.000000 Ti\n0.749999 0.500000 0.000000 Ti\n0.500000 0.000000 0.250000 Ti\n0.500000 0.000000 0.749999 Ti\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 8,
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"elements": [
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"Pt"
],
"chemical_system": "Pt-Ti",
"density": 8.846560687823386,
"density_atomic": 0.06292009828881188,
"volume": 127.14538307424287,
"volume_molar": 9.571092423215152,
"formula_full": "Ti6 Pt2",
"formula_reduced": "Ti3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3554791,
"spacegroup": 223
},
{
"id": "jvasp-7717",
"created_at": "2022-09-04T14:37:02.736620Z",
"updated_at": "2022-09-04T14:37:02.736632Z",
"structure_string": "Ti1 Pt1\n1.0\n3.175648 -0.000000 -0.000000\n-0.000000 3.175648 0.000000\n-0.000000 0.000000 3.175648\nTi Pt\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Pt-Ti",
"density": 12.597104014982014,
"density_atomic": 0.06245006900387236,
"volume": 32.025585109857694,
"volume_molar": 9.643129072646156,
"formula_full": "Ti1 Pt1",
"formula_reduced": "TiPt",
"formula_anonymous": "AB",
"energy_above_hull": 1.7446848666666663,
"spacegroup": 221
},
{
"id": "jvasp-38967",
"created_at": "2022-09-04T14:37:47.678118Z",
"updated_at": "2022-09-04T14:37:47.678138Z",
"structure_string": "Ti2 Pt6\n1.0\n2.802437 -4.853963 0.000000\n2.802437 4.853963 -0.000000\n0.000000 0.000000 4.529995\nTi Pt\n2 6\ndirect\n0.333334 0.666667 0.250000 Ti\n0.666667 0.333334 0.749999 Ti\n0.167623 0.832378 0.749999 Pt\n0.664756 0.832378 0.749999 Pt\n0.167623 0.335245 0.749999 Pt\n0.832378 0.167623 0.250000 Pt\n0.335245 0.167623 0.250000 Pt\n0.832378 0.664756 0.250000 Pt\n",
"nsites": 8,
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"elements": [
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],
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"density": 17.060996818312404,
"density_atomic": 0.06491274113163274,
"volume": 123.24236907169379,
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"formula_full": "Ti2 Pt6",
"formula_reduced": "TiPt3",
"formula_anonymous": "AB3",
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"spacegroup": 194
},
{
"id": "jvasp-37026",
"created_at": "2022-09-04T14:38:05.371752Z",
"updated_at": "2022-09-04T14:38:05.371773Z",
"structure_string": "Ti2 Pt2\n1.0\n2.771465 0.000000 0.000000\n0.000000 4.629243 -0.000000\n0.000000 -0.000000 4.870890\nTi Pt\n2 2\ndirect\n0.500001 0.749999 0.697819 Ti\n0.500001 0.250000 0.302181 Ti\n0.000000 0.749999 0.190511 Pt\n0.000000 0.250000 0.809489 Pt\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Pt-Ti",
"density": 12.91130335843506,
"density_atomic": 0.06400771039956756,
"volume": 62.49247121995204,
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"formula_full": "Ti2 Pt2",
"formula_reduced": "TiPt",
"formula_anonymous": "AB",
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"spacegroup": 51
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{
"id": "jvasp-18782",
"created_at": "2022-09-04T14:35:56.535201Z",
"updated_at": "2022-09-04T14:35:56.535237Z",
"structure_string": "Ti1 Pt8\n1.0\n3.741793 -0.000000 1.240480\n1.870897 5.957107 0.620240\n-0.003676 0.000000 6.274717\nTi Pt\n1 8\ndirect\n0.000000 0.000000 0.000000 Ti\n0.661599 0.676801 0.000000 Pt\n0.338400 0.323199 0.000000 Pt\n0.661598 -0.000000 0.676801 Pt\n0.328809 0.671191 0.671191 Pt\n-0.000001 0.328810 0.671191 Pt\n0.000000 0.671191 0.328810 Pt\n0.671190 0.328810 0.328810 Pt\n0.338400 -0.000000 0.323199 Pt\n",
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"elements": [
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"density": 19.09356615728467,
"density_atomic": 0.06433523137726159,
"volume": 139.89224577780763,
"volume_molar": 9.360564392294147,
"formula_full": "Ti1 Pt8",
"formula_reduced": "TiPt8",
"formula_anonymous": "AB8",
"energy_above_hull": 3.213521059259259,
"spacegroup": 139
},
{
"id": "jvasp-81273",
"created_at": "2022-09-04T14:37:13.255195Z",
"updated_at": "2022-09-04T14:37:13.255211Z",
"structure_string": "Ti2 Pt1 W1\n1.0\n-8.855971 0.000000 -5.112998\n-5.814592 0.287509 -0.154826\n-5.025721 2.518774 -1.521191\nTi Pt W\n2 1 1\ndirect\n0.744599 -0.000001 0.000000 Ti\n0.255402 -0.000000 0.000000 Ti\n0.500000 -0.000000 0.000000 Pt\n0.000000 0.000000 0.000000 W\n",
"nsites": 4,
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"elements": [
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"density_atomic": 0.05889732119003622,
"volume": 67.91480357983902,
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"formula_reduced": "Ti2PtW",
"formula_anonymous": "ABC2",
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"spacegroup": 71
},
{
"id": "jvasp-42884",
"created_at": "2022-09-04T14:36:04.713535Z",
"updated_at": "2022-09-04T14:36:04.713557Z",
"structure_string": "Ti1 Zn1 Pt2\n1.0\n0.000003 3.129810 3.129804\n3.129807 0.000004 3.129804\n3.129809 3.129810 0.000002\nTi Zn Pt\n1 1 2\ndirect\n0.249999 0.250000 0.250000 Ti\n0.749998 0.749999 0.750001 Zn\n0.000000 0.000000 0.000000 Pt\n0.499998 0.499999 0.500000 Pt\n",
"nsites": 4,
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"elements": [
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"Zn",
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],
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"formula_full": "Ti1 Zn1 Pt2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-16609",
"created_at": "2022-09-04T14:37:56.054838Z",
"updated_at": "2022-09-04T14:37:56.054863Z",
"structure_string": "Tl3 Pt3\n1.0\n3.308335 -5.730204 0.000000\n3.308335 5.730204 -0.000000\n0.000000 -0.000000 3.946721\nTl Pt\n3 3\ndirect\n-0.000000 0.499999 0.000000 Tl\n0.499999 0.499999 0.000000 Tl\n0.499999 -0.000000 0.000000 Tl\n0.000000 0.000000 0.000000 Pt\n0.333332 0.666666 0.500000 Pt\n0.666666 0.333332 0.500000 Pt\n",
"nsites": 6,
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"elements": [
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},
{
"id": "jvasp-13733",
"created_at": "2022-09-04T14:36:33.755761Z",
"updated_at": "2022-09-04T14:36:33.755789Z",
"structure_string": "Tl3 Pt3\n1.0\n3.308522 -5.730529 -0.000000\n3.308522 5.730529 -0.000000\n0.000000 0.000000 3.946576\nTl Pt\n3 3\ndirect\n-0.000000 0.500000 -0.000000 Tl\n0.500000 0.500000 0.000000 Tl\n0.500000 -0.000000 0.000000 Tl\n0.000000 0.000000 0.000000 Pt\n0.333333 0.666667 0.500001 Pt\n0.666667 0.333333 0.500001 Pt\n",
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}
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