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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4036",
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"results": [
{
"id": "jvasp-113136",
"created_at": "2022-09-04T14:38:46.884867Z",
"updated_at": "2022-09-04T14:38:46.884890Z",
"structure_string": "Dy1 Mg2 Ti3 S8\n1.0\n6.413138 0.008256 3.992142\n2.217959 6.017664 3.991164\n0.007779 0.006103 7.553837\nDy Mg Ti S\n1 2 3 8\ndirect\n0.499995 0.499997 0.499990 Dy\n0.871763 0.871750 0.871764 Mg\n0.128244 0.128253 0.128251 Mg\n0.500018 0.500013 0.999968 Ti\n0.999975 0.500009 0.500016 Ti\n0.500011 0.999975 0.500016 Ti\n0.740755 0.740760 0.740759 S\n0.245815 0.245837 0.728451 S\n0.245811 0.728448 0.245829 S\n0.728445 0.245808 0.245810 S\n0.754183 0.271549 0.754158 S\n0.271556 0.754185 0.754181 S\n0.259260 0.259250 0.259250 S\n0.754179 0.754157 0.271556 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
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"S"
],
"chemical_system": "Dy-Mg-S-Ti",
"density": 3.4867845332451712,
"density_atomic": 0.048094861308980816,
"volume": 291.09138937023533,
"volume_molar": 12.521380862939465,
"formula_full": "Dy1 Mg2 Ti3 S8",
"formula_reduced": "DyMg2Ti3S8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.210804971428572,
"spacegroup": 166
},
{
"id": "jvasp-117241",
"created_at": "2022-09-04T14:38:46.495082Z",
"updated_at": "2022-09-04T14:38:46.495104Z",
"structure_string": "Dy2 Mg2 V2 S8\n1.0\n6.612071 0.003176 3.884256\n2.208719 6.118776 3.804902\n0.019974 -0.000898 7.536276\nDy Mg V S\n2 2 2 8\ndirect\n0.500000 0.500001 0.499999 Dy\n-0.000000 0.499998 0.500002 Dy\n0.877977 0.872027 0.872019 Mg\n0.122023 0.127972 0.127982 Mg\n0.499999 0.500001 -0.000000 V\n0.500001 1.000001 0.500000 V\n0.712394 0.755149 0.755146 S\n0.266917 0.233333 0.732815 S\n0.266929 0.732812 0.233352 S\n0.722686 0.244865 0.244838 S\n0.733068 0.267188 0.766649 S\n0.277313 0.755137 0.755161 S\n0.287606 0.244850 0.244856 S\n0.733085 0.766667 0.267186 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Dy",
"Mg",
"V",
"S"
],
"chemical_system": "Dy-Mg-S-V",
"density": 3.993370264165687,
"density_atomic": 0.045993845716238366,
"volume": 304.38854985890487,
"volume_molar": 13.093362092732882,
"formula_full": "Dy2 Mg2 V2 S8",
"formula_reduced": "DyMgVS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.81588425,
"spacegroup": 74
},
{
"id": "jvasp-111690",
"created_at": "2022-09-04T14:38:41.493982Z",
"updated_at": "2022-09-04T14:38:41.494011Z",
"structure_string": "Dy6 Mn2 Al2 S14\n1.0\n9.486836 0.000000 0.000000\n-4.743418 8.215841 -0.000000\n0.000000 -0.000000 6.092760\nDy Mn Al S\n6 2 2 14\ndirect\n0.783851 0.158849 0.727048 Dy\n0.374998 0.216149 0.727048 Dy\n0.841151 0.625002 0.727048 Dy\n0.216149 0.841151 0.227048 Dy\n0.625002 0.783851 0.227048 Dy\n0.158849 0.374998 0.227048 Dy\n0.000000 0.000000 0.564891 Mn\n0.000000 0.000000 0.064891 Mn\n0.666667 0.333333 0.154229 Al\n0.333333 0.666667 0.654229 Al\n0.436320 0.522301 0.502598 S\n0.477699 0.914018 0.502598 S\n0.085982 0.563680 0.502598 S\n0.563680 0.477698 0.002598 S\n0.522302 0.085982 0.002598 S\n0.914019 0.436320 0.002598 S\n0.224974 0.126412 0.319781 S\n0.775026 0.873588 0.819781 S\n0.126412 0.901438 0.819781 S\n0.901438 0.775026 0.319781 S\n0.666667 0.333333 0.518679 S\n0.873589 0.098562 0.319781 S\n0.098562 0.224974 0.819781 S\n0.333333 0.666667 0.018679 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Al",
"S"
],
"chemical_system": "Al-Dy-Mn-S",
"density": 5.551923855393964,
"density_atomic": 0.05053866338320985,
"volume": 474.88394811749953,
"volume_molar": 11.915908250950498,
"formula_full": "Dy6 Mn2 Al2 S14",
"formula_reduced": "Dy3MnAlS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.2365957951149427,
"spacegroup": 173
},
{
"id": "jvasp-5059",
"created_at": "2022-09-04T14:35:44.448628Z",
"updated_at": "2022-09-04T14:35:44.448656Z",
"structure_string": "Dy3 Mn3 Ga2 Si1\n1.0\n3.516819 -6.091309 0.000000\n3.516819 6.091309 0.000000\n0.000000 0.000000 3.941765\nDy Mn Ga Si\n3 3 2 1\ndirect\n0.407886 0.000000 0.000000 Dy\n0.592114 0.592114 0.000000 Dy\n0.000000 0.407886 0.000000 Dy\n0.218326 0.218326 0.500001 Mn\n0.000000 0.781675 0.500001 Mn\n0.781675 0.000000 0.500001 Mn\n0.666667 0.333333 0.500001 Ga\n0.333333 0.666667 0.500001 Ga\n0.000000 0.000000 0.000000 Si\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Ga",
"Si"
],
"chemical_system": "Dy-Ga-Mn-Si",
"density": 8.061202178008505,
"density_atomic": 0.053291891716671674,
"volume": 168.8812258316675,
"volume_molar": 11.300294596440553,
"formula_full": "Dy3 Mn3 Ga2 Si1",
"formula_reduced": "Dy3Mn3Ga2Si",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.488400497126436,
"spacegroup": 189
},
{
"id": "jvasp-110594",
"created_at": "2022-09-04T14:38:38.408593Z",
"updated_at": "2022-09-04T14:38:38.408620Z",
"structure_string": "Dy3 Mn3 Ga2 Si1\n1.0\n6.893729 -0.000000 -0.000000\n-3.446863 5.970144 -0.000000\n-0.000000 0.000000 4.151949\nDy Mn Ga Si\n3 3 2 1\ndirect\n0.002733 0.423701 0.500000 Dy\n0.576299 0.579031 0.500000 Dy\n0.420969 0.997267 0.500000 Dy\n0.010839 0.776679 0.000000 Mn\n0.223321 0.234159 0.000000 Mn\n0.765841 0.989161 0.000000 Mn\n0.000000 0.000000 0.500000 Ga\n0.666667 0.333333 0.000000 Ga\n0.333333 0.666667 0.000000 Si\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Ga",
"Si"
],
"chemical_system": "Dy-Ga-Mn-Si",
"density": 7.966914615420728,
"density_atomic": 0.05266856501369371,
"volume": 170.8799166573082,
"volume_molar": 11.434032346304207,
"formula_full": "Dy3 Mn3 Ga2 Si1",
"formula_reduced": "Dy3Mn3Ga2Si",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.4890049415708804,
"spacegroup": 174
},
{
"id": "jvasp-17940",
"created_at": "2022-09-04T14:38:15.312097Z",
"updated_at": "2022-09-04T14:38:15.312108Z",
"structure_string": "Dy3 Mn3 Ga2 Si1\n1.0\n3.516821 -6.091313 0.000000\n3.516821 6.091313 -0.000000\n0.000000 -0.000000 3.941760\nDy Mn Ga Si\n3 3 2 1\ndirect\n0.407886 0.000000 0.500000 Dy\n0.592114 0.592114 0.500000 Dy\n0.000000 0.407886 0.500000 Dy\n0.218326 0.218326 0.000000 Mn\n0.000000 0.781673 0.000000 Mn\n0.781673 0.000000 0.000000 Mn\n0.666667 0.333333 0.000000 Ga\n0.333333 0.666667 0.000000 Ga\n0.000000 0.000000 0.500000 Si\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Ga",
"Si"
],
"chemical_system": "Dy-Ga-Mn-Si",
"density": 8.061202525441752,
"density_atomic": 0.05329189401352201,
"volume": 168.8812185529827,
"volume_molar": 11.30029410940428,
"formula_full": "Dy3 Mn3 Ga2 Si1",
"formula_reduced": "Dy3Mn3Ga2Si",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.488400497126436,
"spacegroup": 189
},
{
"id": "jvasp-119502",
"created_at": "2022-09-04T14:38:50.850697Z",
"updated_at": "2022-09-04T14:38:50.850724Z",
"structure_string": "Dy4 Mn2 Sb2 O14\n1.0\n6.371322 -0.034455 -3.494182\n-2.051542 5.855534 -3.782609\n-0.016659 0.034455 7.266551\nDy Mn Sb O\n4 2 2 14\ndirect\n0.000000 0.500000 -0.000000 Dy\n-0.000000 -0.000000 0.500000 Dy\n-0.000000 0.499999 0.499999 Dy\n0.500000 0.500000 0.000000 Dy\n0.500000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 -0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.590508 0.917084 0.255737 O\n0.161346 0.334770 0.244263 O\n0.580682 0.330682 0.250000 O\n0.167540 0.917539 0.249999 O\n0.409492 0.665229 0.326576 O\n0.838654 0.082916 0.173425 O\n0.832460 0.082460 0.750000 O\n0.838653 0.665229 0.755737 O\n0.419318 0.669317 0.749999 O\n0.161346 0.917083 0.826575 O\n0.126163 0.376162 0.749999 O\n0.873837 0.623837 0.250000 O\n0.409492 0.082915 0.744262 O\n0.590507 0.334770 0.673424 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Sb",
"O"
],
"chemical_system": "Dy-Mn-O-Sb",
"density": 7.51195637186928,
"density_atomic": 0.08108581329670972,
"volume": 271.31749816083686,
"volume_molar": 7.426873475343639,
"formula_full": "Dy4 Mn2 Sb2 O14",
"formula_reduced": "Dy2MnSbO7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.5624509855799364,
"spacegroup": 74
},
{
"id": "jvasp-107712",
"created_at": "2022-09-04T14:37:02.616267Z",
"updated_at": "2022-09-04T14:37:02.616300Z",
"structure_string": "Dy2 Mn4 Si2 C2\n1.0\n5.586098 0.004483 0.000000\n-4.360468 3.491536 0.000000\n-0.000000 -0.000000 6.961212\nDy Mn Si C\n2 4 2 2\ndirect\n0.544021 0.455979 0.250000 Dy\n0.455979 0.544021 0.750000 Dy\n0.831597 0.168402 0.061849 Mn\n0.168403 0.831598 0.938151 Mn\n0.168403 0.831598 0.561849 Mn\n0.831597 0.168402 0.438151 Mn\n0.265068 0.734933 0.250000 Si\n0.734933 0.265067 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Dy-Mn-Si",
"density": 7.635642983001164,
"density_atomic": 0.0735791913782659,
"volume": 135.9079899178375,
"volume_molar": 8.184570456938784,
"formula_full": "Dy2 Mn4 Si2 C2",
"formula_reduced": "DyMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.950965916551724,
"spacegroup": 63
},
{
"id": "jvasp-103106",
"created_at": "2022-09-04T14:36:33.226729Z",
"updated_at": "2022-09-04T14:36:33.226756Z",
"structure_string": "Dy1 Mn2 Si1 Ge1\n1.0\n3.696509 0.003197 -4.677054\n-0.443796 3.669773 -4.677054\n-0.002831 -0.003197 5.961460\nDy Mn Si Ge\n1 2 1 1\ndirect\n0.997431 0.997431 0.000000 Dy\n0.753862 0.253862 0.500001 Mn\n0.253861 0.753861 0.499999 Mn\n0.377289 0.377289 0.000000 Si\n0.617554 0.617555 0.000000 Ge\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Si",
"Ge"
],
"chemical_system": "Dy-Ge-Mn-Si",
"density": 7.670800759635047,
"density_atomic": 0.0619062517696602,
"volume": 80.76728693903034,
"volume_molar": 9.727839415003004,
"formula_full": "Dy1 Mn2 Si1 Ge1",
"formula_reduced": "DyMn2SiGe",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.841443106551724,
"spacegroup": 107
},
{
"id": "jvasp-120450",
"created_at": "2022-09-04T14:38:38.002723Z",
"updated_at": "2022-09-04T14:38:38.002742Z",
"structure_string": "Dy4 Mo4 Br4 O16\n1.0\n6.561581 -0.042048 -2.046664\n-1.013001 6.884378 -1.848995\n-0.028287 0.097704 10.877549\nDy Mo Br O\n4 4 4 16\ndirect\n0.647933 0.121983 0.732747 Dy\n0.352067 0.878017 0.267254 Dy\n0.387616 0.657209 0.766996 Dy\n0.612384 0.342790 0.233005 Dy\n0.731682 0.811935 0.132828 Mo\n0.268317 0.188065 0.867173 Mo\n0.776097 0.597527 0.627414 Mo\n0.223902 0.402472 0.372586 Mo\n0.814984 0.289577 0.022273 Br\n0.185016 0.710423 0.977728 Br\n0.742357 0.010584 0.481219 Br\n0.257643 0.989416 0.518782 Br\n0.330467 0.488340 0.549490 O\n0.669533 0.511660 0.450511 O\n0.273362 0.586114 0.299590 O\n0.726638 0.413886 0.700411 O\n0.956983 0.340031 0.331251 O\n0.043017 0.659968 0.668749 O\n0.599350 0.014147 0.176871 O\n0.331509 0.273923 0.042128 O\n0.375884 0.354605 0.797518 O\n0.624115 0.645395 0.202483 O\n-0.000233 0.128546 0.793630 O\n0.000233 0.871453 0.206370 O\n0.655518 0.794536 0.702142 O\n0.668490 0.726076 0.957873 O\n0.400650 0.985853 0.823130 O\n0.344481 0.205464 0.297859 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
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"Mo",
"Br",
"O"
],
"chemical_system": "Br-Dy-Mo-O",
"density": 5.432966311701586,
"density_atomic": 0.05692342407371786,
"volume": 491.88889206206227,
"volume_molar": 10.57937195099352,
"formula_full": "Dy4 Mo4 Br4 O16",
"formula_reduced": "DyMoBrO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.389277215,
"spacegroup": 2
},
{
"id": "jvasp-57345",
"created_at": "2022-09-04T14:37:42.692668Z",
"updated_at": "2022-09-04T14:37:42.692690Z",
"structure_string": "Dy2 Mo2 Cl2 O8\n1.0\n6.091449 0.001456 1.513380\n1.776958 5.826506 1.513380\n0.012407 0.009189 6.848161\nDy Mo Cl O\n2 2 2 8\ndirect\n0.778265 0.778266 0.108968 Dy\n0.221736 0.221736 0.891031 Dy\n0.362498 0.362498 0.269742 Mo\n0.637503 0.637504 0.730258 Mo\n0.009082 0.009081 0.237916 Cl\n0.990919 0.990920 0.762084 Cl\n0.490168 0.110308 0.153655 O\n0.110308 0.490168 0.153655 O\n0.294670 0.294670 0.536175 O\n0.889693 0.509833 0.846345 O\n0.705331 0.705332 0.463825 O\n0.509832 0.889693 0.846345 O\n0.542218 0.542219 0.201451 O\n0.457783 0.457783 0.798549 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Dy",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Dy-Mo-O",
"density": 4.893967039216371,
"density_atomic": 0.05764474081354041,
"volume": 242.8669086271871,
"volume_molar": 10.446990783564136,
"formula_full": "Dy2 Mo2 Cl2 O8",
"formula_reduced": "DyMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4089314953571432,
"spacegroup": 12
},
{
"id": "jvasp-119307",
"created_at": "2022-09-04T14:38:30.088755Z",
"updated_at": "2022-09-04T14:38:30.088773Z",
"structure_string": "Dy2 Mo2 Cl2 O8\n1.0\n6.083768 0.015005 1.515417\n1.759971 5.823655 1.515417\n0.005781 0.004303 6.838316\nDy Mo Cl O\n2 2 2 8\ndirect\n0.778381 0.778382 0.108799 Dy\n0.221619 0.221619 0.891202 Dy\n0.362551 0.362551 0.269715 Mo\n0.637449 0.637450 0.730286 Mo\n0.009087 0.009087 0.238698 Cl\n0.990913 0.990914 0.761303 Cl\n0.110314 0.490297 0.153475 O\n0.490296 0.110315 0.153475 O\n0.294507 0.294507 0.536144 O\n0.509703 0.889686 0.846527 O\n0.705493 0.705494 0.463857 O\n0.889685 0.509704 0.846527 O\n0.542244 0.542245 0.201816 O\n0.457756 0.457756 0.798185 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
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"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Dy-Mo-O",
"density": 4.911087297253415,
"density_atomic": 0.057846395795949995,
"volume": 242.02026431144017,
"volume_molar": 10.410572131827836,
"formula_full": "Dy2 Mo2 Cl2 O8",
"formula_reduced": "DyMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.407655781071429,
"spacegroup": 12
}
]
}