HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=44",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=42",
"results": [
{
"id": "jvasp-19888",
"created_at": "2022-09-04T14:36:10.990163Z",
"updated_at": "2022-09-04T14:36:10.990189Z",
"structure_string": "Zr2 Cr4\n1.0\n4.358590 -0.000000 2.516433\n1.452864 4.109318 2.516433\n-0.000000 -0.000000 5.032866\nZr Cr\n2 4\ndirect\n0.874999 0.875000 0.875000 Zr\n0.125000 0.125000 0.125000 Zr\n0.499999 0.500000 0.500000 Cr\n0.499999 0.500000 -0.000001 Cr\n-0.000001 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Cr"
],
"chemical_system": "Cr-Zr",
"density": 7.192234050010281,
"density_atomic": 0.06656104233612997,
"volume": 90.14281912383969,
"volume_molar": 9.047545754449706,
"formula_full": "Zr2 Cr4",
"formula_reduced": "ZrCr2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.092793100000001,
"spacegroup": 227
},
{
"id": "jvasp-123385",
"created_at": "2022-09-04T14:38:50.632467Z",
"updated_at": "2022-09-04T14:38:50.632498Z",
"structure_string": "Zr1 Cr1\n1.0\n1.606494 -2.782527 -0.000000\n1.606494 2.782527 -0.000000\n-0.000000 -0.000000 3.931257\nZr Cr\n1 1\ndirect\n0.333332 0.666666 0.750001 Zr\n0.666666 0.333332 0.250000 Cr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Cr"
],
"chemical_system": "Cr-Zr",
"density": 6.766641115782224,
"density_atomic": 0.05690495298596527,
"volume": 35.146325496363545,
"volume_molar": 10.582805966793908,
"formula_full": "Zr1 Cr1",
"formula_reduced": "ZrCr",
"formula_anonymous": "AB",
"energy_above_hull": 3.3164109500000003,
"spacegroup": 187
},
{
"id": "jvasp-18670",
"created_at": "2022-09-04T14:37:05.090117Z",
"updated_at": "2022-09-04T14:37:05.090138Z",
"structure_string": "Zr3 Co3 Sn3\n1.0\n3.561431 -6.168579 -0.000000\n3.561431 6.168579 -0.000000\n-0.000000 0.000000 3.620800\nZr Co Sn\n3 3 3\ndirect\n-0.000000 0.602090 0.500000 Zr\n0.397910 0.397910 0.500000 Zr\n0.602090 -0.000000 0.500000 Zr\n0.000000 0.000000 0.500000 Co\n0.666667 0.333333 0.000000 Co\n0.333333 0.666667 0.000000 Co\n0.733970 0.733970 0.000000 Sn\n0.266030 -0.000000 0.000000 Sn\n-0.000000 0.266030 0.000000 Sn\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Sn"
],
"chemical_system": "Co-Sn-Zr",
"density": 8.419067094570547,
"density_atomic": 0.05657158039928507,
"volume": 159.09048211977722,
"volume_molar": 10.645169743350685,
"formula_full": "Zr3 Co3 Sn3",
"formula_reduced": "ZrCoSn",
"formula_anonymous": "ABC",
"energy_above_hull": 2.209359033333333,
"spacegroup": 189
},
{
"id": "jvasp-56189",
"created_at": "2022-09-04T14:37:20.008334Z",
"updated_at": "2022-09-04T14:37:20.008373Z",
"structure_string": "Zr1 Co2 Si2\n1.0\n3.537655 0.000000 -1.276592\n-0.460669 3.507532 -1.276592\n-0.008081 -0.009212 5.517621\nZr Co Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.750000 0.500000 Co\n0.749999 0.250000 0.500000 Co\n0.377532 0.377533 0.755065 Si\n0.622467 0.622467 0.244935 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Si"
],
"chemical_system": "Co-Si-Zr",
"density": 6.441429599706364,
"density_atomic": 0.07311881265205539,
"volume": 68.38185439078583,
"volume_molar": 8.236103051422727,
"formula_full": "Zr1 Co2 Si2",
"formula_reduced": "Zr(CoSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.5013687,
"spacegroup": 139
},
{
"id": "jvasp-111607",
"created_at": "2022-09-04T14:38:27.679937Z",
"updated_at": "2022-09-04T14:38:27.679962Z",
"structure_string": "Zr4 Co4 Si4\n1.0\n3.872693 -0.000000 0.000000\n0.000000 6.493917 0.000000\n0.000000 0.000000 7.130087\nZr Co Si\n4 4 4\ndirect\n0.250000 0.005594 0.305645 Zr\n0.250000 0.505594 0.194356 Zr\n0.750000 0.994407 0.694356 Zr\n0.750000 0.494407 0.805645 Zr\n0.250000 0.144730 0.929970 Co\n0.250000 0.644730 0.570031 Co\n0.750000 0.855270 0.070031 Co\n0.750000 0.355270 0.429970 Co\n0.250000 0.282838 0.603196 Si\n0.250000 0.782838 0.896804 Si\n0.750000 0.717163 0.396804 Si\n0.750000 0.217163 0.103196 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Si"
],
"chemical_system": "Co-Si-Zr",
"density": 6.602466338083809,
"density_atomic": 0.06692164579004428,
"volume": 179.31417941585053,
"volume_molar": 8.99879357255122,
"formula_full": "Zr4 Co4 Si4",
"formula_reduced": "ZrCoSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.898914666666667,
"spacegroup": 62
},
{
"id": "jvasp-18207",
"created_at": "2022-09-04T14:38:11.891023Z",
"updated_at": "2022-09-04T14:38:11.891039Z",
"structure_string": "Zr1 Co1 Sb1\n1.0\n3.870930 -0.000000 2.234882\n1.290310 3.649548 2.234882\n-0.000000 -0.000000 4.469764\nZr Co Sb\n1 1 1\ndirect\n0.500000 0.500000 0.499999 Zr\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.249999 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Sb"
],
"chemical_system": "Co-Sb-Zr",
"density": 7.150670689245069,
"density_atomic": 0.04750969731861362,
"volume": 63.14500342700864,
"volume_molar": 12.675603297604278,
"formula_full": "Zr1 Co1 Sb1",
"formula_reduced": "ZrCoSb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.770020500000001,
"spacegroup": 216
},
{
"id": "jvasp-87062",
"created_at": "2022-09-04T14:35:59.762384Z",
"updated_at": "2022-09-04T14:35:59.762403Z",
"structure_string": "Zr4 Co4 P4\n1.0\n3.710715 0.000000 0.000000\n-0.000000 6.361405 0.000000\n0.000000 0.000000 7.162497\nZr Co P\n4 4 4\ndirect\n0.250000 0.518977 0.315961 Zr\n0.250000 0.018976 0.184040 Zr\n0.749999 0.981025 0.815961 Zr\n0.749999 0.481024 0.684040 Zr\n0.749999 0.361181 0.061373 Co\n0.250000 0.138820 0.561373 Co\n0.749999 0.861181 0.438627 Co\n0.250000 0.638820 0.938627 Co\n0.250000 0.774128 0.612884 P\n0.250000 0.274128 0.887116 P\n0.749999 0.225872 0.387116 P\n0.749999 0.725873 0.112884 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"Co",
"P"
],
"chemical_system": "Co-P-Zr",
"density": 7.115848148695358,
"density_atomic": 0.07097512192745355,
"volume": 169.07332702106058,
"volume_molar": 8.484861450686152,
"formula_full": "Zr4 Co4 P4",
"formula_reduced": "ZrCoP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.743566966666667,
"spacegroup": 62
},
{
"id": "jvasp-117050",
"created_at": "2022-09-04T14:38:47.959928Z",
"updated_at": "2022-09-04T14:38:47.959945Z",
"structure_string": "Zr2 Co8 N8\n1.0\n4.970644 0.007545 1.366305\n1.222864 4.454719 1.401153\n-0.003252 0.024304 8.116702\nZr Co N\n2 8 8\ndirect\n0.656174 0.882648 0.798814 Zr\n0.343825 0.117350 0.201187 Zr\n0.766749 0.037210 0.401252 Co\n0.264701 0.537973 0.408517 Co\n0.735298 0.462025 0.591483 Co\n0.233250 0.962788 0.598749 Co\n0.869706 0.218398 0.060754 Co\n0.174599 0.396298 0.762256 Co\n0.825401 0.603700 0.237745 Co\n0.130293 0.781600 0.939247 Co\n0.535599 0.780409 0.415009 N\n0.974455 0.714717 0.581743 N\n0.025544 0.285281 0.418258 N\n0.759664 0.899984 0.037946 N\n0.240335 0.100014 0.962054 N\n0.405241 0.626539 0.770012 N\n0.594758 0.373459 0.229989 N\n0.464400 0.219589 0.584991 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zr",
"Co",
"N"
],
"chemical_system": "Co-N-Zr",
"density": 7.084203284879519,
"density_atomic": 0.10025459167692713,
"volume": 179.5428987233367,
"volume_molar": 6.006847825390877,
"formula_full": "Zr2 Co8 N8",
"formula_reduced": "Zr(CoN)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 4.974990122222222,
"spacegroup": 2
},
{
"id": "jvasp-105281",
"created_at": "2022-09-04T14:36:51.543829Z",
"updated_at": "2022-09-04T14:36:51.543852Z",
"structure_string": "Zr2 Co2 H6\n1.0\n5.496145 -0.009972 0.000000\n-4.357847 3.349160 0.000000\n0.000000 -0.000000 4.298943\nZr Co H\n2 2 6\ndirect\n0.634066 0.365934 0.250000 Zr\n0.365934 0.634066 0.749999 Zr\n0.071982 0.928017 0.749999 Co\n0.928017 0.071983 0.250000 Co\n0.573578 0.426422 0.749999 H\n0.186493 0.813507 0.496905 H\n0.186493 0.813507 0.003095 H\n0.813507 0.186494 0.996904 H\n0.813507 0.186494 0.503095 H\n0.426421 0.573579 0.250000 H\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zr",
"Co",
"H"
],
"chemical_system": "Co-H-Zr",
"density": 6.44398867663966,
"density_atomic": 0.1266691139237486,
"volume": 78.94584315178624,
"volume_molar": 4.754229798769388,
"formula_full": "Zr2 Co2 H6",
"formula_reduced": "ZrCoH3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.17738108,
"spacegroup": 63
},
{
"id": "jvasp-58246",
"created_at": "2022-09-04T14:37:57.073461Z",
"updated_at": "2022-09-04T14:37:57.073489Z",
"structure_string": "Zr1 Co6 Ge6\n1.0\n2.543249 -4.405037 0.000000\n2.543249 4.405037 -0.000000\n0.000000 0.000000 7.753796\nZr Co Ge\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.749940 Co\n-0.000000 0.500000 0.250060 Co\n0.500000 -0.000000 0.250060 Co\n0.500000 0.500000 0.250060 Co\n-0.000000 0.500000 0.749940 Co\n0.500000 -0.000000 0.749940 Co\n0.666667 0.333333 0.500000 Ge\n0.000000 0.000000 0.339355 Ge\n0.000000 0.000000 0.660645 Ge\n0.333333 0.666667 0.000000 Ge\n0.666667 0.333333 0.000000 Ge\n0.333333 0.666667 0.500000 Ge\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Zr",
"density": 8.41736427387754,
"density_atomic": 0.07482738065894626,
"volume": 173.73319613113756,
"volume_molar": 8.04804432143383,
"formula_full": "Zr1 Co6 Ge6",
"formula_reduced": "Zr(CoGe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 2.7020573538461536,
"spacegroup": 191
},
{
"id": "jvasp-34485",
"created_at": "2022-09-04T14:37:19.494286Z",
"updated_at": "2022-09-04T14:37:19.494314Z",
"structure_string": "Zr1 Co1 F6\n1.0\n4.957340 -0.000000 2.862122\n1.652447 4.673826 2.862122\n-0.000000 -0.000000 5.724243\nZr Co F\n1 1 6\ndirect\n0.500000 0.500000 0.499999 Zr\n0.000000 0.000000 0.000000 Co\n0.249760 0.750241 0.750239 F\n0.249760 0.750241 0.249759 F\n0.750241 0.249760 0.249759 F\n0.750241 0.750241 0.249758 F\n0.249759 0.249760 0.750240 F\n0.750241 0.249760 0.750240 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Co",
"F"
],
"chemical_system": "Co-F-Zr",
"density": 3.30716971217541,
"density_atomic": 0.060318520282320626,
"volume": 132.6292482401098,
"volume_molar": 9.983900022436544,
"formula_full": "Zr1 Co1 F6",
"formula_reduced": "ZrCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.5936033868750001,
"spacegroup": 225
},
{
"id": "jvasp-88092",
"created_at": "2022-09-04T14:35:55.319867Z",
"updated_at": "2022-09-04T14:35:55.319893Z",
"structure_string": "Zr1 Co1 F6\n1.0\n4.735178 0.144814 3.031985\n1.731656 4.409562 3.031984\n0.205624 0.144814 5.618946\nZr Co F\n1 1 6\ndirect\n0.500001 0.499999 0.500000 Zr\n0.000000 0.000000 0.000000 Co\n0.621382 0.248210 0.879149 F\n0.248213 0.879147 0.621381 F\n0.120852 0.378618 0.751789 F\n0.751789 0.120851 0.378619 F\n0.378620 0.751788 0.120851 F\n0.879149 0.621380 0.248211 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Co",
"F"
],
"chemical_system": "Co-F-Zr",
"density": 3.9185113149907007,
"density_atomic": 0.0714686045169106,
"volume": 111.93726327910983,
"volume_molar": 8.426274446949733,
"formula_full": "Zr1 Co1 F6",
"formula_reduced": "ZrCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.5914671368750002,
"spacegroup": 148
}
]
}