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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4061",
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{
"id": "jvasp-117642",
"created_at": "2022-09-04T14:38:51.772074Z",
"updated_at": "2022-09-04T14:38:51.772091Z",
"structure_string": "Na2 Ag1 As1\n1.0\n-0.000000 3.412156 3.412156\n3.412156 0.000000 3.412156\n3.412156 3.412156 -0.000000\nNa Ag As\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.500001 0.500001 0.500001 Na\n0.750001 0.750001 0.750001 Ag\n0.000000 0.000000 0.000000 As\n",
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{
"id": "jvasp-22601",
"created_at": "2022-09-04T14:36:17.890728Z",
"updated_at": "2022-09-04T14:36:17.890759Z",
"structure_string": "Rb2 Mn1 F6\n1.0\n5.165493 0.000000 2.982299\n1.721831 4.870074 2.982299\n0.000000 0.000000 5.964598\nRb Mn F\n2 1 6\ndirect\n0.750000 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Mn\n0.217131 0.782868 0.782870 F\n0.217131 0.782868 0.217132 F\n0.782869 0.217131 0.782870 F\n0.782869 0.217131 0.217132 F\n0.782869 0.782868 0.217132 F\n0.217131 0.217131 0.782869 F\n",
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"formula_full": "Rb2 Mn1 F6",
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{
"id": "jvasp-15879",
"created_at": "2022-09-04T14:37:55.718949Z",
"updated_at": "2022-09-04T14:37:55.718983Z",
"structure_string": "Ca4 As2\n1.0\n4.342184 0.000000 -1.238389\n-0.353188 4.327796 -1.238389\n0.082691 0.089715 8.521668\nCa As\n4 2\ndirect\n0.500000 0.000000 -0.000000 Ca\n-0.000000 0.500001 0.000000 Ca\n0.321056 0.321056 0.642113 Ca\n0.678943 0.678944 0.357887 Ca\n0.134619 0.134619 0.269240 As\n0.865379 0.865380 0.730760 As\n",
"nsites": 6,
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"elements": [
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"volume": 161.10477011858194,
"volume_molar": 16.169926712692373,
"formula_full": "Ca4 As2",
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"spacegroup": 139
},
{
"id": "jvasp-109588",
"created_at": "2022-09-04T14:38:27.788890Z",
"updated_at": "2022-09-04T14:38:27.788911Z",
"structure_string": "Pm1 Zn1 Ag2\n1.0\n4.255643 -0.000000 2.456997\n1.418548 4.012259 2.456997\n-0.000000 -0.000000 4.913993\nPm Zn Ag\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Pm\n0.000000 0.000000 0.000000 Zn\n0.750000 0.750000 0.750001 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
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"elements": [
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"density": 8.433701399065331,
"density_atomic": 0.04767287125054681,
"volume": 83.90516230872332,
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"formula_full": "Pm1 Zn1 Ag2",
"formula_reduced": "PmZnAg2",
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"spacegroup": 225
},
{
"id": "jvasp-66365",
"created_at": "2022-09-04T14:35:40.868252Z",
"updated_at": "2022-09-04T14:35:40.868277Z",
"structure_string": "Ba1 Na1 Pb1\n1.0\n-0.000000 4.032198 4.032198\n4.032198 -0.000000 4.032198\n4.032198 4.032198 -0.000000\nBa Na Pb\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Pb\n",
"nsites": 3,
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"elements": [
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"chemical_system": "Ba-Na-Pb",
"density": 4.65447511068907,
"density_atomic": 0.022880510469020985,
"volume": 131.11595582895072,
"volume_molar": 26.319958062796122,
"formula_full": "Ba1 Na1 Pb1",
"formula_reduced": "BaNaPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0758344649999999,
"spacegroup": 216
},
{
"id": "jvasp-115913",
"created_at": "2022-09-04T14:38:40.341802Z",
"updated_at": "2022-09-04T14:38:40.341816Z",
"structure_string": "Rb1 Pb1 Cl1\n1.0\n3.703943 -0.000000 0.000000\n0.000000 3.703943 0.000000\n-0.000000 0.000000 9.120147\nRb Pb Cl\n1 1 1\ndirect\n0.000000 0.000000 -0.036911 Rb\n0.000000 0.000000 0.570912 Pb\n0.000000 0.000000 0.283409 Cl\n",
"nsites": 3,
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"elements": [
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"formula_full": "Rb1 Pb1 Cl1",
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"formula_anonymous": "ABC",
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"spacegroup": 99
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{
"id": "jvasp-18692",
"created_at": "2022-09-04T14:36:59.446802Z",
"updated_at": "2022-09-04T14:36:59.446835Z",
"structure_string": "Dy2 Ga2\n1.0\n4.037799 0.000000 -0.000000\n-0.000000 4.021482 -1.573608\n0.000000 -0.041619 5.819055\nDy Ga\n2 2\ndirect\n0.250000 0.860682 0.721366 Dy\n0.750000 0.139318 0.278635 Dy\n0.250000 0.577652 0.155306 Ga\n0.750000 0.422347 0.844695 Ga\n",
"nsites": 4,
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"density": 8.184990545846087,
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},
{
"id": "jvasp-92307",
"created_at": "2022-09-04T14:35:49.017655Z",
"updated_at": "2022-09-04T14:35:49.017678Z",
"structure_string": "Ga2 Cu4\n1.0\n-4.227599 -0.000000 0.000000\n-2.113800 -2.586982 3.664974\n-2.113800 2.586982 3.664974\nGa Cu\n2 4\ndirect\n0.499964 0.750036 0.250036 Ga\n0.500037 0.249963 0.749963 Ga\n0.166572 0.333432 0.333423 Cu\n0.833429 0.666567 0.666576 Cu\n0.833429 0.166577 0.166567 Cu\n0.166573 0.833422 0.833431 Cu\n",
"nsites": 6,
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"elements": [
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"volume": 80.16560733430708,
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"formula_full": "Ga2 Cu4",
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"spacegroup": 191
},
{
"id": "jvasp-113479",
"created_at": "2022-09-04T14:38:45.052756Z",
"updated_at": "2022-09-04T14:38:45.052783Z",
"structure_string": "Ba2 I1\n1.0\n4.750471 -0.405215 0.246282\n-0.615551 -7.230801 -0.023034\n0.100369 -1.536639 -4.464507\nBa I\n2 1\ndirect\n0.545625 0.081918 0.455748 Ba\n0.045627 0.489146 0.752096 Ba\n0.045623 0.912026 0.040699 I\n",
"nsites": 3,
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"elements": [
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"volume": 154.71259303026667,
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},
{
"id": "jvasp-106934",
"created_at": "2022-09-04T14:36:58.354861Z",
"updated_at": "2022-09-04T14:36:58.354895Z",
"structure_string": "Ca3 Sm1\n1.0\n5.151240 -0.000000 2.974070\n1.717080 4.856636 2.974070\n-0.000000 -0.000000 5.948140\nCa Sm\n3 1\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750001 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Sm\n",
"nsites": 4,
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{
"id": "jvasp-25344",
"created_at": "2022-09-04T14:37:51.581720Z",
"updated_at": "2022-09-04T14:37:51.581752Z",
"structure_string": "Mn1\n1.0\n2.142782 -0.000000 1.237136\n0.714261 2.020235 1.237136\n0.000000 -0.000000 2.474272\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n",
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{
"id": "jvasp-16080",
"created_at": "2022-09-04T14:35:47.290733Z",
"updated_at": "2022-09-04T14:35:47.290761Z",
"structure_string": "Mn1\n1.0\n2.142782 -0.000000 1.237136\n0.714261 2.020235 1.237136\n-0.000000 0.000000 2.474272\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n",
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