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_anonymous&page=4075",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=4073",
"results": [
{
"id": "jvasp-16672",
"created_at": "2022-09-04T14:38:32.182129Z",
"updated_at": "2022-09-04T14:38:32.182164Z",
"structure_string": "Ce1 Ag1\n1.0\n3.170514 0.000000 0.000000\n-0.000000 3.170514 0.000000\n0.000000 -0.000000 4.614599\nCe Ag\n1 1\ndirect\n0.499999 0.499999 0.500000 Ce\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ce",
"Ag"
],
"chemical_system": "Ag-Ce",
"density": 8.8772773894857,
"density_atomic": 0.043115822720578914,
"volume": 46.386682980895834,
"volume_molar": 13.967356715022555,
"formula_full": "Ce1 Ag1",
"formula_reduced": "CeAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.58759638,
"spacegroup": 123
},
{
"id": "jvasp-19718",
"created_at": "2022-09-04T14:38:32.234097Z",
"updated_at": "2022-09-04T14:38:32.234122Z",
"structure_string": "Nd1 Se1\n1.0\n3.660322 0.000000 2.113288\n1.220107 3.450985 2.113288\n0.000000 0.000000 4.226577\nNd Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.499999 0.500001 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nd",
"Se"
],
"chemical_system": "Nd-Se",
"density": 6.942182558521693,
"density_atomic": 0.037460955155851745,
"volume": 53.38892165667542,
"volume_molar": 16.075780062055593,
"formula_full": "Nd1 Se1",
"formula_reduced": "NdSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0565924333333334,
"spacegroup": 225
},
{
"id": "jvasp-26248",
"created_at": "2022-09-04T14:38:32.260038Z",
"updated_at": "2022-09-04T14:38:32.260073Z",
"structure_string": "As16 S16\n1.0\n0.000000 6.611614 -0.050628\n13.595015 0.000000 0.000000\n0.000000 -4.074574 -8.951973\nAs S\n16 16\ndirect\n0.354991 0.024958 0.119834 As\n0.671972 0.161542 0.962380 As\n0.671972 0.338458 0.462380 As\n0.328028 0.838458 0.037620 As\n0.141149 0.627792 0.822333 As\n0.858851 0.127792 0.677667 As\n0.858851 0.372208 0.177667 As\n0.141149 0.872209 0.322333 As\n0.328028 0.661543 0.537620 As\n0.424714 0.137394 0.571690 As\n0.424713 0.362606 0.071690 As\n0.575286 0.862606 0.428310 As\n0.354991 0.475042 0.619834 As\n0.645009 0.975043 0.880166 As\n0.645009 0.524958 0.380166 As\n0.575287 0.637394 0.928310 As\n0.944251 0.287459 0.393822 S\n0.055749 0.787459 0.106178 S\n0.607726 0.725532 0.741051 S\n0.392274 0.225532 0.758949 S\n0.392274 0.274468 0.258949 S\n0.607726 0.774468 0.241051 S\n0.092055 0.475549 0.713454 S\n0.092055 0.024451 0.213454 S\n0.907945 0.524452 0.286546 S\n0.646937 0.489664 0.846157 S\n0.353063 0.989664 0.653843 S\n0.353063 0.510336 0.153843 S\n0.646937 0.010336 0.346157 S\n0.944251 0.212541 0.893822 S\n0.907945 0.975549 0.786546 S\n0.055749 0.712541 0.606178 S\n",
"nsites": 32,
"nelements": 2,
"elements": [
"As",
"S"
],
"chemical_system": "As-S",
"density": 3.520314650630779,
"density_atomic": 0.03963081423825972,
"volume": 807.4524991491872,
"volume_molar": 15.195601896531832,
"formula_full": "As16 S16",
"formula_reduced": "AsS",
"formula_anonymous": "AB",
"energy_above_hull": 1.328755875,
"spacegroup": 14
},
{
"id": "jvasp-118575",
"created_at": "2022-09-04T14:38:35.093726Z",
"updated_at": "2022-09-04T14:38:35.093754Z",
"structure_string": "K2 Se2\n1.0\n4.670766 0.000000 0.000000\n0.000000 4.670766 0.000000\n0.000000 0.000000 6.611166\nK Se\n2 2\ndirect\n-0.000000 0.000000 0.250337 K\n0.500001 0.500001 0.749666 K\n-0.000000 0.000000 0.750542 Se\n0.500001 0.500001 0.249457 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Se"
],
"chemical_system": "K-Se",
"density": 2.71844991541823,
"density_atomic": 0.027733565611763177,
"volume": 144.22956124701838,
"volume_molar": 21.714267989564643,
"formula_full": "K2 Se2",
"formula_reduced": "KSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2813183416666666,
"spacegroup": 225
},
{
"id": "jvasp-29222",
"created_at": "2022-09-04T14:38:35.160336Z",
"updated_at": "2022-09-04T14:38:35.160363Z",
"structure_string": "Bi6 Te6\n1.0\n4.484082 -0.000000 0.000000\n-2.242041 3.883329 -0.000000\n0.000000 0.000000 24.628122\nBi Te\n6 6\ndirect\n0.333333 0.666667 0.290888 Bi\n0.666667 0.333333 0.709112 Bi\n-0.000000 -0.000000 0.874087 Bi\n-0.000000 -0.000000 0.125913 Bi\n0.666667 0.333333 0.465845 Bi\n0.333333 0.666667 0.534155 Bi\n0.333333 0.666667 0.056484 Te\n0.666667 0.333333 0.943516 Te\n-0.000000 -0.000000 0.638750 Te\n-0.000000 -0.000000 0.361250 Te\n0.666667 0.333333 0.208976 Te\n0.333333 0.666667 0.791024 Te\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Bi",
"Te"
],
"chemical_system": "Bi-Te",
"density": 7.819520847701743,
"density_atomic": 0.02798157898492474,
"volume": 428.8535685018018,
"volume_molar": 21.521804624551272,
"formula_full": "Bi6 Te6",
"formula_reduced": "BiTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.5033460333333334,
"spacegroup": 164
},
{
"id": "jvasp-111051",
"created_at": "2022-09-04T14:38:37.186568Z",
"updated_at": "2022-09-04T14:38:37.186594Z",
"structure_string": "Hf1 Nb1\n1.0\n2.968057 -0.017158 0.000000\n-0.994380 2.796581 0.000000\n-0.000000 -0.000000 4.794680\nHf Nb\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500000 0.499999 0.500000 Nb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Nb"
],
"chemical_system": "Hf-Nb",
"density": 11.34716828691437,
"density_atomic": 0.05035752110976664,
"volume": 39.71601373388707,
"volume_molar": 11.958771256578055,
"formula_full": "Hf1 Nb1",
"formula_reduced": "HfNb",
"formula_anonymous": "AB",
"energy_above_hull": 3.7019462,
"spacegroup": 65
},
{
"id": "jvasp-19695",
"created_at": "2022-09-04T14:38:32.317767Z",
"updated_at": "2022-09-04T14:38:32.317790Z",
"structure_string": "Al4 Au4\n1.0\n0.000000 6.260210 -0.134811\n3.598640 0.000000 0.000000\n0.000000 -0.137087 -6.301524\nAl Au\n4 4\ndirect\n0.425264 0.250000 0.180141 Al\n0.574736 0.750000 0.819858 Al\n0.074868 0.250000 0.680157 Al\n0.925132 0.750000 0.319842 Al\n0.690457 0.250000 0.508001 Au\n0.309543 0.750000 0.491998 Au\n0.809567 0.250000 0.007895 Au\n0.190432 0.750000 -0.007895 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
"Au"
],
"chemical_system": "Al-Au",
"density": 10.473218817664836,
"density_atomic": 0.056326618365275694,
"volume": 142.02876423577118,
"volume_molar": 10.691465127458349,
"formula_full": "Al4 Au4",
"formula_reduced": "AlAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.4842051850000001,
"spacegroup": 62
},
{
"id": "jvasp-115904",
"created_at": "2022-09-04T14:38:40.694762Z",
"updated_at": "2022-09-04T14:38:40.694788Z",
"structure_string": "P2 Cl2\n1.0\n5.134693 0.512104 1.041196\n-1.466403 -7.491347 0.006917\n-1.744000 -1.332978 -2.783842\nP Cl\n2 2\ndirect\n0.038629 0.261203 0.071319 P\n0.651906 0.281103 0.165531 P\n0.089419 0.953521 0.429185 Cl\n0.601123 0.588786 0.807573 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"P",
"Cl"
],
"chemical_system": "Cl-P",
"density": 2.360324018910397,
"density_atomic": 0.04279661708032506,
"volume": 93.4653314417911,
"volume_molar": 14.07153455306299,
"formula_full": "P2 Cl2",
"formula_reduced": "PCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.8340897837499999,
"spacegroup": 11
},
{
"id": "jvasp-55203",
"created_at": "2022-09-04T14:38:32.318012Z",
"updated_at": "2022-09-04T14:38:32.318043Z",
"structure_string": "Pu4 Ga4\n1.0\n5.469846 0.146425 -2.460366\n-3.222427 4.944871 -1.076226\n0.095421 -0.146425 5.996959\nPu Ga\n4 4\ndirect\n-0.000000 0.149740 0.149740 Pu\n-0.000001 0.850258 0.850258 Pu\n0.500000 0.250000 0.750000 Pu\n0.500000 0.750000 0.249999 Pu\n-0.000001 0.698777 0.301222 Ga\n0.602446 0.301223 0.301222 Ga\n-0.000001 0.301222 0.698777 Ga\n0.397554 0.698777 0.698776 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pu",
"Ga"
],
"chemical_system": "Ga-Pu",
"density": 12.693969700718949,
"density_atomic": 0.04873399296023708,
"volume": 164.15646480121873,
"volume_molar": 12.357166721211557,
"formula_full": "Pu4 Ga4",
"formula_reduced": "PuGa",
"formula_anonymous": "AB",
"energy_above_hull": 2.4479011625,
"spacegroup": 139
},
{
"id": "jvasp-17318",
"created_at": "2022-09-04T14:38:32.359496Z",
"updated_at": "2022-09-04T14:38:32.359506Z",
"structure_string": "Pa1 As1\n1.0\n3.544630 0.000000 2.046493\n1.181543 3.341908 2.046493\n0.000000 0.000000 4.092986\nPa As\n1 1\ndirect\n0.500000 0.500000 0.500000 Pa\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pa",
"As"
],
"chemical_system": "As-Pa",
"density": 10.47863021879307,
"density_atomic": 0.041250036554993715,
"volume": 48.48480551850277,
"volume_molar": 14.599116177682424,
"formula_full": "Pa1 As1",
"formula_reduced": "PaAs",
"formula_anonymous": "AB",
"energy_above_hull": 1.8308824250000004,
"spacegroup": 225
},
{
"id": "jvasp-116232",
"created_at": "2022-09-04T14:38:40.808162Z",
"updated_at": "2022-09-04T14:38:40.808198Z",
"structure_string": "La1 S1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nLa S\n1 1\ndirect\n0.000000 0.000000 0.872933 La\n0.000000 0.000000 0.127067 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"S"
],
"chemical_system": "La-S",
"density": 0.48874316792296546,
"density_atomic": 0.0034430275049691906,
"volume": 580.8841193146079,
"volume_molar": 174.90829658806018,
"formula_full": "La1 S1",
"formula_reduced": "LaS",
"formula_anonymous": "AB",
"energy_above_hull": 1.7465875,
"spacegroup": 99
},
{
"id": "jvasp-119011",
"created_at": "2022-09-04T14:38:32.435959Z",
"updated_at": "2022-09-04T14:38:32.435980Z",
"structure_string": "Mg8 O8\n1.0\n5.686084 0.006645 -5.824014\n-0.413358 4.027715 -7.060976\n-0.027951 -0.006645 8.139405\nMg O\n8 8\ndirect\n0.738050 0.070469 0.667580 Mg\n0.261950 0.929533 0.332419 Mg\n0.597112 0.429533 0.167581 Mg\n0.402888 0.570469 0.832419 Mg\n0.025172 0.689819 0.335353 Mg\n0.974827 0.310182 0.664647 Mg\n0.645535 0.810182 0.835353 Mg\n0.354465 0.189819 0.164647 Mg\n0.024623 0.190127 0.834494 O\n0.975376 0.809874 0.165506 O\n0.644367 0.309873 0.334495 O\n0.355633 0.690128 0.665505 O\n0.741820 0.570446 0.171375 O\n0.258179 0.429555 0.828625 O\n0.600929 0.929556 0.671374 O\n0.399070 0.070445 0.328625 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.8864456859061,
"density_atomic": 0.08625649915457533,
"volume": 185.4932689921407,
"volume_molar": 6.981666099395092,
"formula_full": "Mg8 O8",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0561399999999998,
"spacegroup": 72
}
]
}