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=energy_above_hull&page=3549",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=3547",
"results": [
{
"id": "jvasp-106673",
"created_at": "2022-09-04T14:36:51.131520Z",
"updated_at": "2022-09-04T14:36:51.131556Z",
"structure_string": "Ce4 Y2 Si4\n1.0\n7.551592 0.000000 0.000000\n0.000000 7.551592 0.000000\n0.000000 0.000000 4.337987\nCe Y Si\n4 2 4\ndirect\n0.677980 0.177980 0.500000 Ce\n0.322019 0.822019 0.500000 Ce\n0.177980 0.322019 0.500000 Ce\n0.822019 0.677980 0.500000 Ce\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 -0.000000 Y\n0.116317 0.616317 -0.000000 Si\n0.883683 0.383683 -0.000000 Si\n0.616317 0.883683 -0.000000 Si\n0.383683 0.116317 -0.000000 Si\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Y",
"Si"
],
"chemical_system": "Ce-Si-Y",
"density": 5.709764962943778,
"density_atomic": 0.04042357492119708,
"volume": 247.38039669906232,
"volume_molar": 14.897595701863926,
"formula_full": "Ce4 Y2 Si4",
"formula_reduced": "Ce2YSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7539907299999995,
"spacegroup": 127
},
{
"id": "jvasp-74494",
"created_at": "2022-09-04T14:36:03.712256Z",
"updated_at": "2022-09-04T14:36:03.712274Z",
"structure_string": "Be2 Si1 Ru1\n1.0\n-1.719858 1.719858 3.650429\n1.719858 -1.719858 3.650429\n1.719858 1.719858 -3.650429\nBe Si Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Si\n0.500000 0.500000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Si",
"Ru"
],
"chemical_system": "Be-Ru-Si",
"density": 5.658592449292736,
"density_atomic": 0.09261277818517416,
"volume": 43.190584262597326,
"volume_molar": 6.502494448400047,
"formula_full": "Be2 Si1 Ru1",
"formula_reduced": "Be2SiRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.753995325,
"spacegroup": 119
},
{
"id": "jvasp-46119",
"created_at": "2022-09-04T14:38:07.404091Z",
"updated_at": "2022-09-04T14:38:07.404113Z",
"structure_string": "Na4 V2 P2 C2 O14\n1.0\n0.000000 5.206627 -0.013733\n6.411050 0.000000 0.000000\n0.000000 -0.330734 -8.968660\nNa V P C O\n4 2 2 2 14\ndirect\n0.781313 0.226639 0.915934 Na\n0.255146 0.471724 0.728419 Na\n0.744855 0.971724 0.271580 Na\n0.218688 0.726639 0.084066 Na\n0.784468 0.759281 0.662484 V\n0.215533 0.259281 0.337516 V\n0.717369 0.253524 0.574846 P\n0.282632 0.753524 0.425153 P\n0.706755 0.749186 0.933608 C\n0.293247 0.249186 0.066391 C\n0.478093 0.236369 0.168774 O\n0.228768 0.562886 0.321567 O\n0.210205 0.943088 0.323332 O\n0.878667 0.243993 0.434894 O\n0.571672 0.766068 0.469226 O\n0.428330 0.266068 0.530774 O\n0.939467 0.750790 0.880192 O\n0.789796 0.443088 0.676668 O\n0.771234 0.062886 0.678433 O\n0.521908 0.736369 0.831226 O\n0.060534 0.250790 0.119808 O\n0.332665 0.264469 0.928576 O\n0.121335 0.743993 0.565106 O\n0.667336 0.764469 0.071424 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Na",
"V",
"P",
"C",
"O"
],
"chemical_system": "C-Na-O-P-V",
"density": 2.7941780229785795,
"density_atomic": 0.08015964982133579,
"volume": 299.4025055435311,
"volume_molar": 7.512683467832603,
"formula_full": "Na4 V2 P2 C2 O14",
"formula_reduced": "Na2VPCO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.754051016666666,
"spacegroup": 4
},
{
"id": "jvasp-40833",
"created_at": "2022-09-04T14:37:51.213373Z",
"updated_at": "2022-09-04T14:37:51.213392Z",
"structure_string": "Hf1 Bi1 Rh1\n1.0\n4.037770 0.000000 2.331207\n1.345923 3.806846 2.331207\n0.000000 0.000000 4.662415\nHf Bi Rh\n1 1 1\ndirect\n0.250000 0.250000 0.250001 Hf\n0.499999 0.500001 0.500001 Bi\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Hf",
"Bi",
"Rh"
],
"chemical_system": "Bi-Hf-Rh",
"density": 11.362146978527836,
"density_atomic": 0.04186040655596003,
"volume": 71.66676692424201,
"volume_molar": 14.386245274396588,
"formula_full": "Hf1 Bi1 Rh1",
"formula_reduced": "HfBiRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7540767666666666,
"spacegroup": 216
},
{
"id": "jvasp-29832",
"created_at": "2022-09-04T14:37:36.789695Z",
"updated_at": "2022-09-04T14:37:36.789720Z",
"structure_string": "As12 H4 O24\n1.0\n11.021712 0.000000 -6.254784\n0.000000 4.620454 0.000000\n-0.220549 0.000000 11.251620\nAs H O\n12 4 24\ndirect\n0.953902 0.213867 0.633035 As\n0.046098 0.713867 0.866965 As\n0.046098 0.786132 0.366965 As\n0.953902 0.286133 0.133035 As\n0.443189 0.537334 0.634445 As\n0.556811 0.037335 0.865555 As\n0.556811 0.462665 0.365555 As\n0.443189 0.962664 0.134445 As\n0.240703 0.360049 0.721105 As\n0.759297 0.860048 0.778895 As\n0.759297 0.639951 0.278895 As\n0.240703 0.139951 0.221105 As\n0.275118 0.674675 0.319283 H\n0.724882 0.174675 0.180717 H\n0.724882 0.325324 0.680717 H\n0.275118 0.825324 0.819283 H\n0.664222 0.593592 0.678499 O\n0.335778 0.093592 0.821501 O\n0.233140 0.868389 0.323982 O\n0.766860 0.368389 0.176019 O\n0.766860 0.131610 0.676019 O\n0.233140 0.631610 0.823982 O\n0.486986 0.336203 0.185410 O\n0.513014 0.836203 0.314590 O\n0.513014 0.663796 0.814590 O\n0.486986 0.163796 0.685410 O\n0.282080 0.987828 0.109244 O\n0.045026 0.417316 0.311547 O\n0.717920 0.012171 0.890756 O\n0.282080 0.512170 0.609244 O\n0.091950 0.259672 0.108725 O\n0.908050 0.759671 0.391275 O\n0.908050 0.740327 0.891275 O\n0.091950 0.240328 0.608725 O\n0.664222 0.906407 0.178500 O\n0.954974 0.917316 0.188453 O\n0.954974 0.582683 0.688453 O\n0.045026 0.082683 0.811547 O\n0.717920 0.487829 0.390756 O\n0.335778 0.406407 0.321501 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"As",
"H",
"O"
],
"chemical_system": "As-H-O",
"density": 3.7719227487733353,
"density_atomic": 0.07059424572788112,
"volume": 566.6184203481339,
"volume_molar": 8.530639711363277,
"formula_full": "As12 H4 O24",
"formula_reduced": "As3HO6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.754091625,
"spacegroup": 14
},
{
"id": "jvasp-55245",
"created_at": "2022-09-04T14:38:13.713509Z",
"updated_at": "2022-09-04T14:38:13.713530Z",
"structure_string": "Nd4 Ta4 O16\n1.0\n0.000000 7.642263 -0.007688\n5.515210 0.000000 0.000000\n0.000000 -1.324997 -7.643158\nNd Ta O\n4 4 16\ndirect\n0.348209 0.223401 0.101346 Nd\n0.651791 0.723401 0.398655 Nd\n0.651791 0.776599 0.898655 Nd\n0.348208 0.276599 0.601346 Nd\n0.165418 0.730857 0.306122 Ta\n0.834581 0.230857 0.193878 Ta\n0.834581 0.269143 0.693879 Ta\n0.165418 0.769143 0.806122 Ta\n0.939826 0.907007 0.300565 O\n0.060174 0.407007 0.199436 O\n0.166202 0.647864 0.556819 O\n0.833797 0.147865 0.943182 O\n0.833798 0.352135 0.443182 O\n0.166202 0.852135 0.056818 O\n0.384238 0.513379 0.330539 O\n0.331560 0.991048 0.371090 O\n0.615761 0.486621 0.669461 O\n0.384238 0.986621 0.830540 O\n0.939825 0.592993 0.800565 O\n0.668439 0.491048 0.128910 O\n0.668439 0.008952 0.628911 O\n0.331560 0.508952 0.871090 O\n0.615762 0.013379 0.169461 O\n0.060174 0.092993 0.699436 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Nd",
"Ta",
"O"
],
"chemical_system": "Nd-O-Ta",
"density": 8.022973304166642,
"density_atomic": 0.0744866837465233,
"volume": 322.2052425057816,
"volume_molar": 8.0848555165823,
"formula_full": "Nd4 Ta4 O16",
"formula_reduced": "NdTaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.754489116666667,
"spacegroup": 14
},
{
"id": "jvasp-86377",
"created_at": "2022-09-04T14:35:58.603615Z",
"updated_at": "2022-09-04T14:35:58.603635Z",
"structure_string": "Ce7 O12\n1.0\n6.679356 -0.017567 -1.117982\n-1.317814 6.548089 -1.117983\n-0.014423 -0.017567 6.772257\nCe O\n7 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.138827 0.600910 0.299492 Ce\n0.299492 0.138826 0.600910 Ce\n0.399091 0.700508 0.861175 Ce\n0.861175 0.399089 0.700509 Ce\n0.700509 0.861173 0.399091 Ce\n0.600910 0.299492 0.138827 Ce\n0.566231 0.417885 0.822316 O\n0.417886 0.822315 0.566231 O\n0.932094 0.072310 0.678398 O\n0.582115 0.177684 0.433770 O\n0.822316 0.566230 0.417886 O\n0.321603 0.067906 0.927690 O\n0.927690 0.321602 0.067907 O\n0.067908 0.927689 0.321603 O\n0.678399 0.932093 0.072311 O\n0.072311 0.678397 0.932094 O\n0.433770 0.582115 0.177685 O\n0.177685 0.433769 0.582115 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 6.584276511871063,
"density_atomic": 0.06423723363411274,
"volume": 295.7786150664835,
"volume_molar": 9.374844493306425,
"formula_full": "Ce7 O12",
"formula_reduced": "Ce7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.754658289473684,
"spacegroup": 148
},
{
"id": "jvasp-85878",
"created_at": "2022-09-04T14:36:04.091866Z",
"updated_at": "2022-09-04T14:36:04.091890Z",
"structure_string": "Ce7 O12\n1.0\n6.678731 -0.017630 -1.117931\n-1.317754 6.547463 -1.117932\n-0.014474 -0.017630 6.771633\nCe O\n7 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.138831 0.600918 0.299499 Ce\n0.299499 0.138830 0.600919 Ce\n0.399082 0.700501 0.861170 Ce\n0.861170 0.399081 0.700501 Ce\n0.700502 0.861169 0.399082 Ce\n0.600919 0.299499 0.138830 Ce\n0.566221 0.417884 0.822314 O\n0.417885 0.822314 0.566221 O\n0.932100 0.072303 0.678393 O\n0.582116 0.177686 0.433780 O\n0.822315 0.566220 0.417885 O\n0.321607 0.067900 0.927697 O\n0.927697 0.321607 0.067901 O\n0.067901 0.927697 0.321607 O\n0.678394 0.932099 0.072303 O\n0.072304 0.678393 0.932100 O\n0.433780 0.582115 0.177686 O\n0.177686 0.433779 0.582115 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 6.586163884083425,
"density_atomic": 0.06425564713323319,
"volume": 295.6938549012473,
"volume_molar": 9.372157979380669,
"formula_full": "Ce7 O12",
"formula_reduced": "Ce7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.7546593421052634,
"spacegroup": 148
},
{
"id": "jvasp-120020",
"created_at": "2022-09-04T14:38:37.135974Z",
"updated_at": "2022-09-04T14:38:37.135987Z",
"structure_string": "H4 Br1 N1\n1.0\n3.995601 0.000000 -0.000000\n-0.000000 3.995601 0.000000\n-0.000000 0.000000 3.995601\nH Br N\n4 1 1\ndirect\n0.150499 0.150499 0.849499 H\n0.150499 0.849499 0.150499 H\n0.849499 0.150499 0.150499 H\n0.849499 0.849499 0.849499 H\n0.499999 0.499999 0.499999 Br\n0.000000 0.000000 0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"Br",
"N"
],
"chemical_system": "Br-H-N",
"density": 2.549610070866028,
"density_atomic": 0.09405998625218225,
"volume": 63.78908012928608,
"volume_molar": 6.40244699149133,
"formula_full": "H4 Br1 N1",
"formula_reduced": "H4BrN",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.754949559166667,
"spacegroup": 215
},
{
"id": "jvasp-16158",
"created_at": "2022-09-04T14:36:32.629438Z",
"updated_at": "2022-09-04T14:36:32.629458Z",
"structure_string": "U1 Si1 Au1\n1.0\n2.145161 -3.715529 -0.000000\n2.145161 3.715529 0.000000\n0.000000 0.000000 3.902822\nU Si Au\n1 1 1\ndirect\n0.000000 0.000000 0.000000 U\n0.333333 0.666667 0.500000 Si\n0.666667 0.333333 0.500000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"U",
"Si",
"Au"
],
"chemical_system": "Au-Si-U",
"density": 12.359951087139434,
"density_atomic": 0.048220528569275105,
"volume": 62.21416664253498,
"volume_molar": 12.488748959581407,
"formula_full": "U1 Si1 Au1",
"formula_reduced": "USiAu",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7550440566666667,
"spacegroup": 187
},
{
"id": "jvasp-42567",
"created_at": "2022-09-04T14:36:12.966899Z",
"updated_at": "2022-09-04T14:36:12.966925Z",
"structure_string": "Li2 Mg2 Mn1 Fe1 P4 O16\n1.0\n4.783543 -0.008854 0.002133\n-0.068369 5.900800 -0.000052\n-0.123612 -0.012911 10.010835\nLi Mg Mn Fe P O\n2 2 1 1 4 16\ndirect\n-0.000975 0.539382 -0.008305 Li\n0.489820 0.958365 0.492966 Li\n0.028803 0.748985 0.277966 Mg\n0.472820 0.749592 0.776293 Mg\n0.554867 0.250114 0.218681 Mn\n0.968372 0.247530 0.723763 Fe\n0.919337 0.747868 0.595258 P\n0.572951 0.751973 0.094436 P\n0.093550 0.251710 0.400844 P\n0.415154 0.249300 0.907039 P\n0.679675 0.751023 0.951432 O\n0.789494 0.545087 0.676405 O\n0.770006 0.241594 0.380558 O\n0.732684 0.262682 0.890468 O\n0.709261 0.953199 0.176503 O\n0.726641 0.545768 0.166381 O\n0.337378 0.247108 0.057653 O\n0.228608 0.452682 0.326373 O\n0.273845 0.049734 0.829750 O\n0.257509 0.738735 0.105671 O\n0.236117 0.761499 0.607679 O\n0.771410 0.956555 0.666929 O\n0.237807 0.039342 0.339647 O\n0.161909 0.252085 0.551895 O\n0.260764 0.457552 0.842657 O\n0.812188 0.750545 0.451052 O\n",
"nsites": 26,
"nelements": 6,
"elements": [
"Li",
"Mg",
"Mn",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Li-Mg-Mn-O-P",
"density": 3.2506955485900035,
"density_atomic": 0.0920130426551029,
"volume": 282.56863646447493,
"volume_molar": 6.544877319808988,
"formula_full": "Li2 Mg2 Mn1 Fe1 P4 O16",
"formula_reduced": "Li2Mg2MnFe(PO4)4",
"formula_anonymous": "ABC2D2E4F16",
"energy_above_hull": 2.755044186206897,
"spacegroup": 1
},
{
"id": "jvasp-20518",
"created_at": "2022-09-04T14:37:48.897775Z",
"updated_at": "2022-09-04T14:37:48.897803Z",
"structure_string": "Ta2 As2\n1.0\n3.338419 -0.000000 -0.945035\n-0.267520 3.327684 -0.945035\n0.002227 0.002413 6.377013\nTa As\n2 2\ndirect\n0.000006 0.000006 0.000014 Ta\n0.750007 0.250006 0.500013 Ta\n0.417695 0.417693 0.835385 As\n0.167694 0.667693 0.335386 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"As"
],
"chemical_system": "As-Ta",
"density": 11.99234249151574,
"density_atomic": 0.056450323462567266,
"volume": 70.85876137897486,
"volume_molar": 10.668035877585957,
"formula_full": "Ta2 As2",
"formula_reduced": "TaAs",
"formula_anonymous": "AB",
"energy_above_hull": 2.755045475,
"spacegroup": 109
}
]
}