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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=564",
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"results": [
{
"id": "jvasp-28754",
"created_at": "2022-09-04T14:38:03.382491Z",
"updated_at": "2022-09-04T14:38:03.382513Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.317942 0.000000 0.000000\n-1.658971 2.873431 0.000050\n0.000000 0.000643 37.573013\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333350 0.666701 0.708777 Te\n0.333343 0.666687 0.606661 Te\n0.333322 0.666642 0.093900 Mo\n0.666697 0.333394 0.281763 Mo\n0.333323 0.666647 0.469468 W\n0.666684 0.333367 0.657864 W\n0.666653 0.333306 0.424473 Se\n0.666667 0.333333 0.514167 Se\n0.333348 0.666697 0.322455 S\n0.666629 0.333257 0.053471 S\n0.666641 0.333281 0.134599 S\n0.333339 0.666680 0.241149 S\n",
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{
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"structure_string": "Pr6 Ag2\n1.0\n7.139254 -0.000000 0.000000\n-3.569627 6.182775 0.000000\n-0.000000 -0.000000 5.410257\nPr Ag\n6 2\ndirect\n0.175479 0.350959 0.250000 Pr\n0.649040 0.824522 0.250000 Pr\n0.175479 0.824522 0.250000 Pr\n0.824520 0.649041 0.750000 Pr\n0.350959 0.175479 0.750000 Pr\n0.824520 0.175479 0.750000 Pr\n0.333333 0.666667 0.750000 Ag\n0.666666 0.333334 0.250000 Ag\n",
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{
"id": "jvasp-15990",
"created_at": "2022-09-04T14:35:56.787357Z",
"updated_at": "2022-09-04T14:35:56.787386Z",
"structure_string": "Ho1 Sb2\n1.0\n3.555239 -0.098772 0.000000\n-1.863047 3.029610 0.000000\n0.000000 0.000000 8.457473\nHo Sb\n1 2\ndirect\n0.000000 0.000000 0.000000 Ho\n-0.000000 0.500000 0.297263 Sb\n0.500000 0.000000 0.702737 Sb\n",
"nsites": 3,
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"elements": [
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"density": 7.574884321397474,
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"volume": 89.53901925727928,
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"formula_full": "Ho1 Sb2",
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"spacegroup": 21
},
{
"id": "jvasp-14256",
"created_at": "2022-09-04T14:37:35.014876Z",
"updated_at": "2022-09-04T14:37:35.014895Z",
"structure_string": "Ho1 Sb2\n1.0\n3.555239 -0.098772 0.000000\n-1.863047 3.029610 0.000000\n0.000000 0.000000 8.457473\nHo Sb\n1 2\ndirect\n0.000000 0.000000 0.000000 Ho\n-0.000000 0.500000 0.297263 Sb\n0.500000 0.000000 0.702737 Sb\n",
"nsites": 3,
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"elements": [
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"density": 7.574884321397474,
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"volume": 89.53901925727928,
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"formula_full": "Ho1 Sb2",
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"spacegroup": 21
},
{
"id": "jvasp-120473",
"created_at": "2022-09-04T14:38:39.124830Z",
"updated_at": "2022-09-04T14:38:39.124851Z",
"structure_string": "Nd16 Mg4 Pt4\n1.0\n8.697640 -0.000000 5.021585\n2.899213 8.200213 5.021585\n-0.000000 -0.000000 10.043169\nNd Mg Pt\n16 4 4\ndirect\n0.348884 0.348884 0.348884 Nd\n0.934647 0.934647 0.565353 Nd\n0.565353 0.565353 0.934647 Nd\n0.934647 0.565353 0.934646 Nd\n0.565353 0.934647 0.565353 Nd\n0.934647 0.565353 0.565353 Nd\n0.809302 0.809302 0.190698 Nd\n0.190698 0.190698 0.809302 Nd\n0.565353 0.934647 0.934647 Nd\n0.190698 0.809302 0.190698 Nd\n0.190698 0.809302 0.809302 Nd\n0.809302 0.190698 0.190698 Nd\n0.953350 0.348884 0.348883 Nd\n0.348883 0.953349 0.348883 Nd\n0.348884 0.348884 0.953350 Nd\n0.809302 0.190698 0.809301 Nd\n0.579419 0.579419 0.579419 Mg\n0.579419 0.579419 0.261744 Mg\n0.579419 0.261744 0.579419 Mg\n0.261744 0.579419 0.579419 Mg\n0.142908 0.571275 0.142908 Pt\n0.142909 0.142908 0.142908 Pt\n0.142909 0.142908 0.571275 Pt\n0.571275 0.142908 0.142908 Pt\n",
"nsites": 24,
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"elements": [
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],
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"density": 7.384473878265549,
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"formula_full": "Nd16 Mg4 Pt4",
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{
"id": "jvasp-37305",
"created_at": "2022-09-04T14:37:55.600339Z",
"updated_at": "2022-09-04T14:37:55.600367Z",
"structure_string": "Sm3 Mg1\n1.0\n-2.455737 2.455737 4.949005\n2.455737 -2.455737 4.949005\n2.455737 2.455737 -4.949005\nSm Mg\n3 1\ndirect\n0.500000 0.500000 0.000000 Sm\n0.750000 0.250000 0.500001 Sm\n0.250000 0.750000 0.500001 Sm\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
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"elements": [
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"spacegroup": 139
},
{
"id": "jvasp-107486",
"created_at": "2022-09-04T14:37:02.757360Z",
"updated_at": "2022-09-04T14:37:02.757388Z",
"structure_string": "K2 Pd1 Br6\n1.0\n6.271853 -0.000000 3.621056\n2.090618 5.913160 3.621056\n-0.000000 -0.000000 7.242113\nK Pd Br\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750001 K\n0.000000 0.000000 0.000000 Pd\n0.755239 0.244761 0.244762 Br\n0.244761 0.755239 0.755239 Br\n0.244761 0.755239 0.244762 Br\n0.755239 0.244761 0.755239 Br\n0.244761 0.244761 0.755239 Br\n0.755239 0.755239 0.244762 Br\n",
"nsites": 9,
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"elements": [
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"Br"
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"density": 4.10547046995046,
"density_atomic": 0.03350901881322935,
"volume": 268.58440857858847,
"volume_molar": 17.971701271129014,
"formula_full": "K2 Pd1 Br6",
"formula_reduced": "K2PdBr6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-37229",
"created_at": "2022-09-04T14:38:01.312098Z",
"updated_at": "2022-09-04T14:38:01.312119Z",
"structure_string": "Sm1 Tm3\n1.0\n4.923743 0.000000 -0.000000\n0.000000 4.923743 -0.000000\n0.000000 0.000000 4.923743\nSm Tm\n1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.500000 0.500000 Tm\n0.500000 0.000000 0.500000 Tm\n0.500000 0.500000 0.000000 Tm\n",
"nsites": 4,
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"density": 9.141886547514165,
"density_atomic": 0.033509956352877894,
"volume": 119.36750850636285,
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"formula_full": "Sm1 Tm3",
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"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-10700",
"created_at": "2022-09-04T14:36:50.428887Z",
"updated_at": "2022-09-04T14:36:50.428897Z",
"structure_string": "Rb4 Sb4 S8\n1.0\n6.491006 0.033948 -0.009967\n-1.594842 6.288621 -0.058588\n-2.237680 -2.614831 11.709564\nRb Sb S\n4 4 8\ndirect\n0.637162 0.759647 0.469128 Rb\n0.504552 0.109274 0.160913 Rb\n0.969157 0.150573 0.895191 Rb\n0.172318 0.718188 0.734820 Rb\n0.653360 0.629014 0.968254 Sb\n0.057778 0.218298 0.401687 Sb\n0.083739 0.650943 0.228270 Sb\n0.487887 0.239537 0.661646 Sb\n0.048260 0.259238 0.180318 S\n0.093553 0.610021 0.449742 S\n0.497815 0.234755 0.906531 S\n0.448043 0.221794 0.437127 S\n0.643634 0.633785 0.723494 S\n0.091146 0.192027 0.633774 S\n0.050192 0.676789 0.996217 S\n0.693410 0.647117 0.192881 S\n",
"nsites": 16,
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"elements": [
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],
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"density": 3.7751322137094623,
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"volume": 477.44047351800435,
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"formula_full": "Rb4 Sb4 S8",
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{
"id": "jvasp-65282",
"created_at": "2022-09-04T14:36:16.883336Z",
"updated_at": "2022-09-04T14:36:16.883345Z",
"structure_string": "Be1 Tl1 Sb4\n1.0\n-0.000000 4.473384 4.473384\n4.473384 -0.000000 4.473384\n4.473384 4.473384 0.000000\nBe Tl Sb\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tl\n0.120909 0.626363 0.626363 Sb\n0.626363 0.626363 0.626363 Sb\n0.626363 0.120909 0.626363 Sb\n0.626363 0.626363 0.120909 Sb\n",
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"volume": 179.03524539915338,
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"formula_full": "Be1 Tl1 Sb4",
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{
"id": "jvasp-9156",
"created_at": "2022-09-04T14:38:31.046374Z",
"updated_at": "2022-09-04T14:38:31.046394Z",
"structure_string": "Te6 As4\n1.0\n4.088668 0.000000 0.000000\n-2.044334 7.248729 -0.697688\n0.000000 -0.060365 10.073460\nTe As\n6 4\ndirect\n0.032065 0.064130 0.286526 Te\n0.967936 0.935869 0.713474 Te\n0.780703 0.561405 0.338644 Te\n0.219298 0.438594 0.661356 Te\n0.374307 0.748612 0.035268 Te\n0.625695 0.251387 0.964732 Te\n0.617192 0.234384 0.441758 As\n0.382809 0.765615 0.558241 As\n0.202655 0.405310 0.140499 As\n0.797346 0.594689 0.859501 As\n",
"nsites": 10,
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"formula_full": "Te6 As4",
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{
"id": "jvasp-110891",
"created_at": "2022-09-04T14:38:37.180745Z",
"updated_at": "2022-09-04T14:38:37.180777Z",
"structure_string": "Yb3 Cd1\n1.0\n4.785988 -0.000000 2.763192\n1.595329 4.512273 2.763192\n-0.000000 -0.000000 5.526383\nYb Cd\n3 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750001 0.749999 0.749999 Yb\n0.500000 0.500000 0.499999 Yb\n0.000000 0.000000 0.000000 Cd\n",
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}