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=updated_at&page=4177",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=4175",
"results": [
{
"id": "jvasp-114995",
"created_at": "2022-09-04T14:38:41.499395Z",
"updated_at": "2022-09-04T14:38:41.499423Z",
"structure_string": "Ge1 F2\n1.0\n4.010568 0.000000 0.010949\n0.000000 2.604788 0.000000\n-0.010482 0.000000 3.855274\nGe F\n1 2\ndirect\n0.633350 0.000000 -0.033467 Ge\n-0.366700 0.000000 -0.533384 F\n0.133350 0.000000 -0.033148 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"F"
],
"chemical_system": "F-Ge",
"density": 4.561545264895318,
"density_atomic": 0.07448769149704297,
"volume": 40.275110420345015,
"volume_molar": 8.084746135862014,
"formula_full": "Ge1 F2",
"formula_reduced": "GeF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1109599999999999,
"spacegroup": 47
},
{
"id": "jvasp-112568",
"created_at": "2022-09-04T14:38:41.500361Z",
"updated_at": "2022-09-04T14:38:41.500382Z",
"structure_string": "Tm6 Si6 Ni2\n1.0\n5.198519 -0.011168 1.789154\n3.553730 3.794170 1.789154\n-0.033599 -0.014523 13.371922\nTm Si Ni\n6 6 2\ndirect\n0.468803 0.468803 0.380467 Tm\n0.531197 0.531197 0.619532 Tm\n0.601139 0.601138 0.078756 Tm\n0.398861 0.398862 0.921243 Tm\n0.252170 0.252170 0.227484 Tm\n0.747830 0.747830 0.772515 Tm\n0.954991 0.954990 0.235888 Si\n0.045009 0.045010 0.764111 Si\n0.883289 0.883288 0.075845 Si\n0.116711 0.116712 0.924154 Si\n0.863183 0.863183 0.543244 Si\n0.136816 0.136817 0.456755 Si\n0.751167 0.751166 0.400358 Ni\n0.248833 0.248834 0.599642 Ni\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Tm",
"Si",
"Ni"
],
"chemical_system": "Ni-Si-Tm",
"density": 8.156764160683608,
"density_atomic": 0.05291988221594862,
"volume": 264.55085336113575,
"volume_molar": 11.37973197942056,
"formula_full": "Tm6 Si6 Ni2",
"formula_reduced": "Tm3Si3Ni",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.2440787071428563,
"spacegroup": 12
},
{
"id": "jvasp-112562",
"created_at": "2022-09-04T14:38:41.502439Z",
"updated_at": "2022-09-04T14:38:41.502455Z",
"structure_string": "Rb4 Pd6 S8\n1.0\n13.374567 -0.085731 4.709317\n12.328629 5.189562 1.535395\n-0.001456 0.007343 6.244712\nRb Pd S\n4 6 8\ndirect\n0.078222 0.078222 0.921778 Rb\n0.921778 0.921778 0.078222 Rb\n0.171778 0.171778 0.328222 Rb\n0.328222 0.328222 0.171778 Rb\n0.999538 0.999537 0.500462 Pd\n0.250463 0.250462 0.749537 Pd\n0.500463 0.500462 0.999537 Pd\n0.750000 0.749999 0.749999 Pd\n0.500000 0.500000 0.500000 Pd\n0.749537 0.749537 0.250462 Pd\n0.972155 0.646427 0.859848 S\n0.603573 0.277846 0.728431 S\n0.728431 0.390151 0.603573 S\n0.277846 0.603573 0.390151 S\n0.390151 0.728431 0.277845 S\n0.646428 0.972154 0.521568 S\n0.521569 0.859848 0.646426 S\n0.859849 0.521568 0.972154 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Rb",
"Pd",
"S"
],
"chemical_system": "Pd-Rb-S",
"density": 4.664381309022204,
"density_atomic": 0.04087699218805155,
"volume": 440.34551067731076,
"volume_molar": 14.732348046293602,
"formula_full": "Rb4 Pd6 S8",
"formula_reduced": "Rb2Pd3S4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.3169019,
"spacegroup": 70
},
{
"id": "jvasp-116273",
"created_at": "2022-09-04T14:38:41.504384Z",
"updated_at": "2022-09-04T14:38:41.504409Z",
"structure_string": "Li1 H2\n1.0\n4.446406 0.000000 0.014345\n0.000000 2.715440 0.000000\n-0.005973 0.000000 2.310419\nLi H\n1 2\ndirect\n0.466663 0.000000 0.133198 Li\n-0.125702 0.000000 -0.366582 H\n0.059040 0.000000 0.633385 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.5331656444558781,
"density_atomic": 0.10754186369870965,
"volume": 27.89611316765748,
"volume_molar": 5.5998106717507605,
"formula_full": "Li1 H2",
"formula_reduced": "LiH2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.82135,
"spacegroup": 47
},
{
"id": "jvasp-115005",
"created_at": "2022-09-04T14:38:41.507460Z",
"updated_at": "2022-09-04T14:38:41.507494Z",
"structure_string": "Ge1 N1 O2\n1.0\n3.593310 0.000000 -0.000000\n0.000000 3.593310 -0.000000\n0.000000 -0.000000 4.657687\nGe N O\n1 1 2\ndirect\n0.500000 0.500000 0.674797 Ge\n0.000000 0.000000 0.885534 N\n0.000000 0.000000 0.135640 O\n0.500000 0.500000 0.314031 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ge",
"N",
"O"
],
"chemical_system": "Ge-N-O",
"density": 3.2759758838518094,
"density_atomic": 0.06651204775819974,
"volume": 60.139480512489136,
"volume_molar": 9.054210421987165,
"formula_full": "Ge1 N1 O2",
"formula_reduced": "GeNO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.67410155,
"spacegroup": 99
},
{
"id": "jvasp-116150",
"created_at": "2022-09-04T14:38:41.508622Z",
"updated_at": "2022-09-04T14:38:41.508647Z",
"structure_string": "Li1 Te1 H1\n1.0\n0.000000 3.030511 3.030511\n3.030511 -0.000000 3.030511\n3.030511 3.030511 0.000000\nLi Te H\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 H\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Te",
"H"
],
"chemical_system": "H-Li-Te",
"density": 4.043594836858106,
"density_atomic": 0.05389440291982506,
"volume": 55.664407386846655,
"volume_molar": 11.173963220185811,
"formula_full": "Li1 Te1 H1",
"formula_reduced": "LiTeH",
"formula_anonymous": "ABC",
"energy_above_hull": 1.330732588888889,
"spacegroup": 216
},
{
"id": "jvasp-116391",
"created_at": "2022-09-04T14:38:41.511303Z",
"updated_at": "2022-09-04T14:38:41.511340Z",
"structure_string": "Pb1 Se1 O1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nPb Se O\n1 1 1\ndirect\n0.000000 0.000000 0.265124 Pb\n0.000000 0.000000 0.746168 Se\n0.000000 0.000000 0.014547 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Pb",
"Se",
"O"
],
"chemical_system": "O-Pb-Se",
"density": 3.306600713507375,
"density_atomic": 0.019770506832558536,
"volume": 151.74117818059824,
"volume_molar": 30.460224469726775,
"formula_full": "Pb1 Se1 O1",
"formula_reduced": "PbSeO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4592225622222224,
"spacegroup": 99
},
{
"id": "jvasp-116017",
"created_at": "2022-09-04T14:38:41.511725Z",
"updated_at": "2022-09-04T14:38:41.511754Z",
"structure_string": "Li2 Mn1 F3\n1.0\n2.833516 -0.000000 0.000000\n-1.416758 2.453897 -0.000000\n0.000000 -0.000000 8.132749\nLi Mn F\n2 1 3\ndirect\n0.333333 0.666667 0.143183 Li\n0.666667 0.333333 0.856816 Li\n0.000000 0.000000 0.500000 Mn\n0.333333 0.666667 0.717212 F\n0.666667 0.333333 0.282788 F\n0.000000 0.000000 0.000000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.6945626065064623,
"density_atomic": 0.10610403074622042,
"volume": 56.54827585533294,
"volume_molar": 5.6756946156020724,
"formula_full": "Li2 Mn1 F3",
"formula_reduced": "Li2MnF3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.5476030148132184,
"spacegroup": 164
},
{
"id": "jvasp-116167",
"created_at": "2022-09-04T14:38:41.513619Z",
"updated_at": "2022-09-04T14:38:41.513636Z",
"structure_string": "Hg1 Cl3\n1.0\n5.027757 -0.503968 -0.110066\n0.867301 -6.415749 0.499467\n1.194387 -0.667467 -3.770523\nHg Cl\n1 3\ndirect\n0.062488 0.976559 0.879675 Hg\n0.465134 0.680955 0.138610 Cl\n0.951959 0.694448 0.635694 Cl\n0.078517 0.237784 0.235669 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"Cl"
],
"chemical_system": "Cl-Hg",
"density": 4.227327125465378,
"density_atomic": 0.03317496912766131,
"volume": 120.57283262593296,
"volume_molar": 18.15266424763222,
"formula_full": "Hg1 Cl3",
"formula_reduced": "HgCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.056631016875,
"spacegroup": 1
},
{
"id": "jvasp-114630",
"created_at": "2022-09-04T14:38:41.513813Z",
"updated_at": "2022-09-04T14:38:41.513831Z",
"structure_string": "Ag1 Pb1 Cl1\n1.0\n3.254495 -0.000000 0.000000\n-0.000000 3.254495 0.000000\n-0.000000 0.000000 7.987198\nAg Pb Cl\n1 1 1\ndirect\n0.000000 0.000000 0.311775 Ag\n0.000000 0.000000 0.673307 Pb\n0.000000 0.000000 0.005232 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ag",
"Pb",
"Cl"
],
"chemical_system": "Ag-Cl-Pb",
"density": 6.8802104004122375,
"density_atomic": 0.035461702890453146,
"volume": 84.59830621410028,
"volume_molar": 16.982096935963153,
"formula_full": "Ag1 Pb1 Cl1",
"formula_reduced": "AgPbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0455,
"spacegroup": 99
},
{
"id": "jvasp-114338",
"created_at": "2022-09-04T14:38:41.514585Z",
"updated_at": "2022-09-04T14:38:41.514609Z",
"structure_string": "Mg1 Si1 N2\n1.0\n2.955592 0.000000 -0.000000\n-0.000000 2.955592 0.000000\n-0.000000 -0.000000 3.949277\nMg Si N\n1 1 2\ndirect\n0.500000 0.500000 0.502496 Mg\n0.000000 0.000000 0.002492 Si\n0.000000 0.000000 0.502505 N\n0.500000 0.500000 0.002506 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Si",
"N"
],
"chemical_system": "Mg-N-Si",
"density": 3.870077406221159,
"density_atomic": 0.11594537528857991,
"volume": 34.49900429442986,
"volume_molar": 5.193946498522528,
"formula_full": "Mg1 Si1 N2",
"formula_reduced": "MgSiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0008760374999994,
"spacegroup": 123
},
{
"id": "jvasp-114449",
"created_at": "2022-09-04T14:38:41.515959Z",
"updated_at": "2022-09-04T14:38:41.515972Z",
"structure_string": "Ba1 Au1 O1\n1.0\n5.087095 -0.000000 -0.000000\n-2.543548 4.405554 -0.000000\n-0.000000 -0.000000 4.363838\nBa Au O\n1 1 1\ndirect\n0.333334 0.666666 0.000000 Ba\n0.000000 0.000000 0.000000 Au\n0.666668 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Au",
"O"
],
"chemical_system": "Au-Ba-O",
"density": 5.947596827615769,
"density_atomic": 0.03067483660399358,
"volume": 97.80003195222979,
"volume_molar": 19.632185291627515,
"formula_full": "Ba1 Au1 O1",
"formula_reduced": "BaAuO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6327190133333331,
"spacegroup": 187
}
]
}