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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=515",
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"results": [
{
"id": "jvasp-86881",
"created_at": "2022-09-04T14:35:49.553065Z",
"updated_at": "2022-09-04T14:35:49.553101Z",
"structure_string": "Ca3 Si1 Br2\n1.0\n4.363838 0.064290 10.666128\n2.149699 3.798158 10.666128\n0.108418 0.064290 11.523784\nCa Si Br\n3 1 2\ndirect\n0.124154 0.124154 0.124154 Ca\n0.000000 0.000000 0.000000 Ca\n0.875847 0.875846 0.875845 Ca\n0.500000 0.500000 0.499999 Si\n0.714702 0.714702 0.714701 Br\n0.285298 0.285298 0.285298 Br\n",
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{
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"structure_string": "Ba2 Hg6\n1.0\n3.613616 -6.258967 0.000000\n3.613616 6.258967 0.000000\n-0.000000 -0.000000 5.410766\nBa Hg\n2 6\ndirect\n0.333333 0.666668 0.750001 Ba\n0.666668 0.333333 0.250000 Ba\n0.695259 0.847630 0.250000 Hg\n0.152371 0.847630 0.250000 Hg\n0.152371 0.304742 0.250000 Hg\n0.304742 0.152371 0.750001 Hg\n0.847630 0.152371 0.750001 Hg\n0.847630 0.695259 0.750001 Hg\n",
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{
"id": "jvasp-36893",
"created_at": "2022-09-04T14:38:02.468193Z",
"updated_at": "2022-09-04T14:38:02.468214Z",
"structure_string": "Rb1 Ca1 Cl3\n1.0\n5.347837 0.000532 0.004973\n-0.000137 5.347399 0.001546\n-0.007136 -0.003307 5.347737\nRb Ca Cl\n1 1 3\ndirect\n0.988571 -0.000170 0.997816 Rb\n0.487985 0.500026 0.498054 Ca\n0.487851 0.000036 0.498366 Cl\n0.987944 0.499828 0.497708 Cl\n0.487652 0.500277 0.998057 Cl\n",
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"elements": [
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"formula_full": "Rb1 Ca1 Cl3",
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"spacegroup": 221
},
{
"id": "jvasp-107609",
"created_at": "2022-09-04T14:36:59.046074Z",
"updated_at": "2022-09-04T14:36:59.046094Z",
"structure_string": "K2 Ag1 Bi1 Cl6\n1.0\n6.549403 -0.000000 3.781300\n2.183134 6.174837 3.781300\n-0.000000 -0.000000 7.562600\nK Ag Bi Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.499999 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.747585 0.252415 0.252415 Cl\n0.252415 0.252415 0.747585 Cl\n0.252414 0.747586 0.747585 Cl\n0.252414 0.747586 0.252415 Cl\n0.747585 0.252415 0.747585 Cl\n0.747584 0.747586 0.252415 Cl\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "Ag-Bi-Cl-K",
"density": 3.299781284050941,
"density_atomic": 0.0326965294651528,
"volume": 305.84285744019917,
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"formula_full": "K2 Ag1 Bi1 Cl6",
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"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-57094",
"created_at": "2022-09-04T14:37:01.223664Z",
"updated_at": "2022-09-04T14:37:01.223690Z",
"structure_string": "Rb4 Sb8 S14\n1.0\n-7.451904 -0.087444 -0.045690\n2.234684 9.381099 -0.177731\n-0.543869 -1.820371 -11.372077\nRb Sb S\n4 8 14\ndirect\n0.287116 0.331923 0.107732 Rb\n0.418896 0.724446 0.559106 Rb\n0.581105 0.275555 0.440894 Rb\n0.712885 0.668077 0.892268 Rb\n0.501220 0.804090 0.233896 Sb\n0.862024 0.562783 0.187593 Sb\n0.959658 0.044258 0.659483 Sb\n0.256184 0.865006 0.950520 Sb\n0.743816 0.134995 0.049480 Sb\n0.137977 0.437217 0.812407 Sb\n0.040342 0.955743 0.340517 Sb\n0.498780 0.195910 0.766104 Sb\n0.945527 0.299625 0.641768 S\n0.762540 0.979132 0.458734 S\n0.110276 0.678026 0.767476 S\n0.889724 0.321975 0.232524 S\n0.553391 0.936810 0.843850 S\n0.446610 0.063191 0.156150 S\n0.818522 0.867935 0.145448 S\n0.054473 0.700376 0.358232 S\n0.237460 0.020869 0.541266 S\n0.439968 0.438612 0.706592 S\n0.669226 0.335874 0.948533 S\n0.560032 0.561389 0.293408 S\n0.330775 0.664127 0.051467 S\n0.181479 0.132065 0.854552 S\n",
"nsites": 26,
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"elements": [
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"S"
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"volume": 795.121391385351,
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"formula_full": "Rb4 Sb8 S14",
"formula_reduced": "Rb2Sb4S7",
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"spacegroup": 2
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{
"id": "jvasp-65165",
"created_at": "2022-09-04T14:36:10.413381Z",
"updated_at": "2022-09-04T14:36:10.413404Z",
"structure_string": "Hf1 Be1 Bi4\n1.0\n0.000000 4.510138 4.510138\n4.510138 0.000000 4.510138\n4.510138 4.510138 0.000000\nHf Be Bi\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Be\n0.124230 0.625257 0.625257 Bi\n0.625257 0.625257 0.625257 Bi\n0.625257 0.124230 0.625257 Bi\n0.625257 0.625257 0.124230 Bi\n",
"nsites": 6,
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"elements": [
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],
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"density": 9.26200721628273,
"density_atomic": 0.03270030197277499,
"volume": 183.48454411813594,
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"formula_full": "Hf1 Be1 Bi4",
"formula_reduced": "HfBeBi4",
"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-14822",
"created_at": "2022-09-04T14:36:22.360563Z",
"updated_at": "2022-09-04T14:36:22.360590Z",
"structure_string": "Tl2\n1.0\n1.779195 -3.081656 0.000000\n1.779195 3.081656 -0.000000\n0.000000 -0.000000 5.576406\nTl\n2\ndirect\n0.333331 0.666666 0.750001 Tl\n0.666666 0.333331 0.250000 Tl\n",
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"volume": 61.149384280012754,
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"formula_full": "Tl2",
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"energy_above_hull": 2.5999999999637424e-06,
"spacegroup": 194
},
{
"id": "jvasp-25337",
"created_at": "2022-09-04T14:37:55.447632Z",
"updated_at": "2022-09-04T14:37:55.447646Z",
"structure_string": "Tl2\n1.0\n3.558386 -0.000000 -0.000000\n-1.779192 3.081652 0.000000\n0.000000 0.000000 5.576418\nTl\n2\ndirect\n0.333334 0.666667 0.250000 Tl\n0.666668 0.333333 0.750000 Tl\n",
"nsites": 2,
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"spacegroup": 194
},
{
"id": "jvasp-5203",
"created_at": "2022-09-04T14:36:42.901551Z",
"updated_at": "2022-09-04T14:36:42.901575Z",
"structure_string": "Sb4 S4 I4\n1.0\n4.112822 0.000000 0.000000\n0.000000 8.640639 0.000000\n0.000000 0.000000 10.323999\nSb S I\n4 4 4\ndirect\n0.750000 0.119547 0.124087 Sb\n0.750000 0.619547 0.375913 Sb\n0.250000 0.880453 0.875913 Sb\n0.250000 0.380453 0.624087 Sb\n0.750000 0.343693 0.454481 S\n0.250000 0.656307 0.545519 S\n0.250000 0.156307 0.954481 S\n0.750000 0.843693 0.045519 S\n0.750000 0.510755 0.827838 I\n0.250000 0.489245 0.172162 I\n0.750000 0.010755 0.672162 I\n0.250000 0.989245 0.327838 I\n",
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"volume": 366.8881870913055,
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{
"id": "jvasp-81217",
"created_at": "2022-09-04T14:37:09.903898Z",
"updated_at": "2022-09-04T14:37:09.903933Z",
"structure_string": "Sr1 Hg2 Bi1\n1.0\n-12.573485 1.940406 -4.090634\n-8.363999 -0.441259 0.378860\n-6.652623 4.399250 -2.585334\nSr Hg Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.752477 -0.002023 -0.002023 Hg\n0.247521 0.002025 0.002025 Hg\n0.499999 0.000001 0.000001 Bi\n",
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},
{
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"created_at": "2022-09-04T14:36:55.269646Z",
"updated_at": "2022-09-04T14:36:55.269681Z",
"structure_string": "Pm2 Tm6\n1.0\n7.116861 -0.000000 0.000000\n-3.558430 6.163383 0.000000\n-0.000000 -0.000000 5.575615\nPm Tm\n2 6\ndirect\n0.666666 0.333333 0.250000 Pm\n0.333333 0.666666 0.750001 Pm\n0.834856 0.165144 0.750001 Tm\n0.330289 0.165144 0.750001 Tm\n0.834856 0.669710 0.750001 Tm\n0.165144 0.834855 0.250000 Tm\n0.669710 0.834855 0.250000 Tm\n0.165144 0.330289 0.250000 Tm\n",
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{
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"structure_string": "Dy1 Ho1\n1.0\n3.560552 -0.000000 0.000000\n-1.780275 3.083529 0.000000\n-0.000000 -0.000000 5.568812\nDy Ho\n1 1\ndirect\n0.666666 0.333333 0.500000 Dy\n0.333332 0.666667 -0.000000 Ho\n",
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