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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4597",
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"results": [
{
"id": "jvasp-57567",
"created_at": "2022-09-04T14:37:20.086020Z",
"updated_at": "2022-09-04T14:37:20.086049Z",
"structure_string": "Ag4 Hg4 S4 Br4\n1.0\n4.662169 0.000000 0.000000\n0.000000 9.797805 0.000000\n0.000000 0.000000 9.487843\nAg Hg S Br\n4 4 4 4\ndirect\n0.000000 0.207013 0.411642 Ag\n0.000000 0.792988 0.588358 Ag\n0.000000 0.207013 0.088358 Ag\n0.000000 0.792988 0.911642 Ag\n0.500000 0.229439 0.750000 Hg\n0.500000 0.770561 0.250000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.253448 0.003608 S\n0.500000 0.746552 -0.003608 S\n0.500000 0.746552 0.503608 S\n0.500000 0.253448 0.496392 S\n0.000000 0.021812 0.750000 Br\n0.000000 0.517782 0.750000 Br\n0.000000 0.482219 0.250000 Br\n0.000000 0.978188 0.250000 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Ag",
"Hg",
"S",
"Br"
],
"chemical_system": "Ag-Br-Hg-S",
"density": 6.443407534798398,
"density_atomic": 0.03691778948841566,
"volume": 433.3953961414889,
"volume_molar": 16.312300501875043,
"formula_full": "Ag4 Hg4 S4 Br4",
"formula_reduced": "AgHgSBr",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 51
},
{
"id": "jvasp-54971",
"created_at": "2022-09-04T14:38:32.454700Z",
"updated_at": "2022-09-04T14:38:32.454722Z",
"structure_string": "Ag2 Hg7 P8 Br6\n1.0\n8.143216 0.007057 1.193149\n1.062277 8.357875 1.366722\n0.019183 0.004692 8.535223\nAg Hg P Br\n2 7 8 6\ndirect\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 -0.000000 Ag\n0.236957 0.733313 0.369286 Hg\n0.129820 0.272267 0.272267 Hg\n0.236957 0.369287 0.733312 Hg\n0.763043 0.266688 0.630713 Hg\n0.000000 0.000000 0.000000 Hg\n0.870181 0.727734 0.727733 Hg\n0.763044 0.630714 0.266687 Hg\n0.931584 0.436738 0.436737 P\n0.425899 0.925101 0.238594 P\n0.574102 0.074900 0.761405 P\n0.255247 0.085853 0.085853 P\n0.068416 0.563263 0.563262 P\n0.744754 0.914148 0.914147 P\n0.574102 0.761406 0.074899 P\n0.425899 0.238595 0.925100 P\n0.849815 0.954504 0.364339 Br\n0.150186 0.635661 0.045497 Br\n0.460310 0.354778 0.354777 Br\n0.539690 0.645223 0.645222 Br\n0.150185 0.045497 0.635660 Br\n0.849815 0.364340 0.954503 Br\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Ag",
"Hg",
"P",
"Br"
],
"chemical_system": "Ag-Br-Hg-P",
"density": 6.712676981972326,
"density_atomic": 0.039613799873007956,
"volume": 580.6057503630632,
"volume_molar": 15.202128498920814,
"formula_full": "Ag2 Hg7 P8 Br6",
"formula_reduced": "Ag2Hg7(P4Br3)2",
"formula_anonymous": "A2B6C7D8",
"energy_above_hull": 0.5999650152173912,
"spacegroup": 12
},
{
"id": "jvasp-109482",
"created_at": "2022-09-04T14:38:19.865537Z",
"updated_at": "2022-09-04T14:38:19.865562Z",
"structure_string": "Rb2 Ga1 Ag1 Br6\n1.0\n6.576754 -0.000000 3.797091\n2.192251 6.200623 3.797091\n-0.000000 -0.000000 7.594181\nRb Ga Ag Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ag\n0.759527 0.240473 0.240473 Br\n0.240473 0.240473 0.759527 Br\n0.240473 0.759527 0.759527 Br\n0.240473 0.759527 0.240473 Br\n0.759527 0.240473 0.759527 Br\n0.759527 0.759527 0.240473 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ga",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ga-Rb",
"density": 4.439415143557464,
"density_atomic": 0.03229030383908999,
"volume": 309.6904894370861,
"volume_molar": 18.649997194234256,
"formula_full": "Rb2 Ga1 Ag1 Br6",
"formula_reduced": "Rb2GaAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109231",
"created_at": "2022-09-04T14:38:20.135762Z",
"updated_at": "2022-09-04T14:38:20.135788Z",
"structure_string": "Na2 Ga1 Ag1 Br6\n1.0\n6.516091 -0.000000 3.762067\n2.172030 6.143430 3.762067\n-0.000000 -0.000000 7.524134\nNa Ga Ag Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ag\n0.758977 0.241023 0.241023 Br\n0.241023 0.241023 0.758977 Br\n0.241023 0.758977 0.758977 Br\n0.241023 0.758977 0.241023 Br\n0.758977 0.241023 0.758977 Br\n0.758977 0.758977 0.241024 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Ga",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ga-Na",
"density": 3.875668254679964,
"density_atomic": 0.03320056110892213,
"volume": 301.19972873930305,
"volume_molar": 18.138671633419005,
"formula_full": "Na2 Ga1 Ag1 Br6",
"formula_reduced": "Na2GaAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110680",
"created_at": "2022-09-04T14:38:36.613043Z",
"updated_at": "2022-09-04T14:38:36.613063Z",
"structure_string": "K2 Ga1 Ag1 Br6\n1.0\n6.546312 -0.000000 3.779515\n2.182104 6.171922 3.779515\n-0.000000 -0.000000 7.559030\nK Ga Ag Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500001 Ag\n0.759239 0.240761 0.240762 Br\n0.240761 0.240761 0.759239 Br\n0.240761 0.759239 0.759240 Br\n0.240761 0.759239 0.240762 Br\n0.759239 0.240761 0.759240 Br\n0.759238 0.759239 0.240762 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Ga",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ga-K",
"density": 3.9974069967962875,
"density_atomic": 0.03274287439080168,
"volume": 305.4099612833398,
"volume_molar": 18.392217763544227,
"formula_full": "K2 Ga1 Ag1 Br6",
"formula_reduced": "K2GaAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-120553",
"created_at": "2022-09-04T14:38:45.436278Z",
"updated_at": "2022-09-04T14:38:45.436308Z",
"structure_string": "Ag4 Hg4 S4 Br1 Cl3\n1.0\n4.523090 -0.004324 0.004703\n0.006751 6.901585 0.033823\n0.002323 0.003083 12.992741\nAg Hg S Br Cl\n4 4 4 1 3\ndirect\n-0.000863 0.791415 0.460286 Ag\n0.000946 0.208780 0.541747 Ag\n0.001209 0.291823 0.042169 Ag\n0.998701 0.700468 0.951448 Ag\n0.499985 0.623132 0.244786 Hg\n0.500024 0.374834 0.756181 Hg\n0.500300 0.125474 0.262602 Hg\n0.499675 0.876512 0.740134 Hg\n0.499526 0.857760 0.385180 S\n0.500544 0.140694 0.616874 S\n0.500754 0.359808 0.121287 S\n0.499122 0.638598 0.878672 S\n0.000646 0.873328 0.133513 Br\n-0.000540 0.137982 0.863052 Cl\n0.999709 0.370315 0.365356 Cl\n0.000255 0.629081 0.636707 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ag",
"Hg",
"S",
"Br",
"Cl"
],
"chemical_system": "Ag-Br-Cl-Hg-S",
"density": 6.339210758575263,
"density_atomic": 0.03944893752057689,
"volume": 405.58760274986537,
"volume_molar": 15.265660214191577,
"formula_full": "Ag4 Hg4 S4 Br1 Cl3",
"formula_reduced": "Ag4Hg4S4BrCl3",
"formula_anonymous": "AB3C4D4E4",
"energy_above_hull": 0.0,
"spacegroup": 6
},
{
"id": "jvasp-107417",
"created_at": "2022-09-04T14:36:57.608897Z",
"updated_at": "2022-09-04T14:36:57.608907Z",
"structure_string": "Rb2 Ce1 Ag1 Br6\n1.0\n6.959975 -0.000000 4.018343\n2.319992 6.561927 4.018343\n-0.000000 -0.000000 8.036686\nRb Ce Ag Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Ag\n0.753050 0.246950 0.246950 Br\n0.246950 0.246950 0.753050 Br\n0.246949 0.753050 0.753050 Br\n0.246949 0.753050 0.246950 Br\n0.753050 0.246950 0.753050 Br\n0.753049 0.753050 0.246950 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ce",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ce-Rb",
"density": 4.064204923165686,
"density_atomic": 0.027244818891438732,
"volume": 367.0422636996257,
"volume_molar": 22.103801768681844,
"formula_full": "Rb2 Ce1 Ag1 Br6",
"formula_reduced": "Rb2CeAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-104808",
"created_at": "2022-09-04T14:36:55.319585Z",
"updated_at": "2022-09-04T14:36:55.319614Z",
"structure_string": "K2 Ce1 Ag1 Br6\n1.0\n6.943457 -0.000000 4.008807\n2.314486 6.546354 4.008807\n-0.000000 -0.000000 8.017614\nK Ce Ag Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Ag\n0.753194 0.246807 0.246807 Br\n0.246807 0.246807 0.753193 Br\n0.246808 0.753193 0.753193 Br\n0.246808 0.753193 0.246807 Br\n0.753194 0.246807 0.753193 Br\n0.753194 0.753193 0.246807 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Ce",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Ce-K",
"density": 3.670715808098686,
"density_atomic": 0.02743971646391214,
"volume": 364.4352525709108,
"volume_molar": 21.946803888881767,
"formula_full": "K2 Ce1 Ag1 Br6",
"formula_reduced": "K2CeAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-56474",
"created_at": "2022-09-04T14:37:39.154848Z",
"updated_at": "2022-09-04T14:37:39.154872Z",
"structure_string": "Ag2 Br2\n1.0\n0.000000 4.091983 -0.040912\n4.092767 0.000000 0.000000\n0.000000 -0.059144 -5.786428\nAg Br\n2 2\ndirect\n0.750078 0.750001 0.749927 Ag\n0.249923 0.250000 0.250073 Ag\n0.250057 0.250000 0.750039 Br\n0.749944 0.750001 0.249961 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Br"
],
"chemical_system": "Ag-Br",
"density": 6.43434899581527,
"density_atomic": 0.041271876630464874,
"volume": 96.91829707223432,
"volume_molar": 14.591390679712275,
"formula_full": "Ag2 Br2",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.000105,
"spacegroup": 225
},
{
"id": "jvasp-109922",
"created_at": "2022-09-04T14:38:17.542998Z",
"updated_at": "2022-09-04T14:38:17.543024Z",
"structure_string": "Ag6 Br2\n1.0\n6.465941 0.000000 0.000000\n-3.232972 5.599669 0.000000\n-0.000000 -0.000000 4.686327\nAg Br\n6 2\ndirect\n0.148245 0.296490 0.250000 Ag\n0.703510 0.851755 0.250000 Ag\n0.148245 0.851755 0.250000 Ag\n0.851755 0.703510 0.750000 Ag\n0.296490 0.148245 0.750000 Ag\n0.851755 0.148245 0.750000 Ag\n0.333334 0.666667 0.750000 Br\n0.666667 0.333333 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ag",
"Br"
],
"chemical_system": "Ag-Br",
"density": 7.8977831539946735,
"density_atomic": 0.0471480031521003,
"volume": 169.67844797566204,
"volume_molar": 12.772843720597173,
"formula_full": "Ag6 Br2",
"formula_reduced": "Ag3Br",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-8583",
"created_at": "2022-09-04T14:36:32.516815Z",
"updated_at": "2022-09-04T14:36:32.516841Z",
"structure_string": "Ag1 Br1\n1.0\n3.543282 -0.000000 2.045715\n1.181094 3.340639 2.045715\n0.000000 0.000000 4.091431\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.499999 0.500000 0.499999 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"Br"
],
"chemical_system": "Ag-Br",
"density": 6.438280527416961,
"density_atomic": 0.04129709467308881,
"volume": 48.429556990199046,
"volume_molar": 14.582480456971028,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-78458",
"created_at": "2022-09-04T14:36:32.300645Z",
"updated_at": "2022-09-04T14:36:32.300670Z",
"structure_string": "Ag1 Br1\n1.0\n-0.000000 0.000000 3.565431\n3.566097 0.000000 -0.000000\n0.000000 3.566097 0.000000\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"Br"
],
"chemical_system": "Ag-Br",
"density": 6.876731246722897,
"density_atomic": 0.0441094512933937,
"volume": 45.34175650241066,
"volume_molar": 13.652721998158112,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.087405,
"spacegroup": 221
}
]
}