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=id&page=904",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=902",
"results": [
{
"id": "jvasp-115802",
"created_at": "2022-09-04T14:38:40.139652Z",
"updated_at": "2022-09-04T14:38:40.139669Z",
"structure_string": "Ca1 Si1 N2\n1.0\n2.978745 0.000000 0.000000\n0.000000 2.978745 -0.000000\n-0.000000 0.000000 5.496372\nCa Si N\n1 1 2\ndirect\n0.499999 0.499999 0.542725 Ca\n0.000000 0.000000 0.085039 Si\n0.000000 0.000000 0.388592 N\n0.499999 0.499999 0.993643 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Si",
"N"
],
"chemical_system": "Ca-N-Si",
"density": 3.2747420829879452,
"density_atomic": 0.08201951937841269,
"volume": 48.76887880243771,
"volume_molar": 7.3423263213915035,
"formula_full": "Ca1 Si1 N2",
"formula_reduced": "CaSiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.1160888799999995,
"spacegroup": 99
},
{
"id": "jvasp-115803",
"created_at": "2022-09-04T14:38:29.345856Z",
"updated_at": "2022-09-04T14:38:29.345876Z",
"structure_string": "Ca1 Si2 N2\n1.0\n3.088757 -0.000000 0.000000\n0.000000 3.088757 0.000000\n0.000000 0.000000 7.539621\nCa Si N\n1 2 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.500001 0.500001 0.153834 Si\n0.500001 0.500001 0.846166 Si\n0.000000 0.500001 0.726134 N\n0.500001 0.000000 0.273866 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Si",
"N"
],
"chemical_system": "Ca-N-Si",
"density": 2.868612153598716,
"density_atomic": 0.06951091472878418,
"volume": 71.93114951096337,
"volume_molar": 8.663590147672531,
"formula_full": "Ca1 Si2 N2",
"formula_reduced": "Ca(SiN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.345218824,
"spacegroup": 115
},
{
"id": "jvasp-115804",
"created_at": "2022-09-04T14:38:47.632792Z",
"updated_at": "2022-09-04T14:38:47.632818Z",
"structure_string": "Ca1 Si1 N1\n1.0\n3.898608 -0.000000 0.000000\n0.000000 3.898608 0.000000\n-0.000000 0.000000 6.813492\nCa Si N\n1 1 1\ndirect\n0.000000 0.000000 0.420565 Ca\n0.000000 0.000000 -0.034101 Si\n0.000000 0.000000 0.732880 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Si",
"N"
],
"chemical_system": "Ca-N-Si",
"density": 1.317572591365124,
"density_atomic": 0.028968924048356107,
"volume": 103.55924835151896,
"volume_molar": 20.78827901908817,
"formula_full": "Ca1 Si1 N1",
"formula_reduced": "CaSiN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.438290756666666,
"spacegroup": 99
},
{
"id": "jvasp-115805",
"created_at": "2022-09-04T14:38:50.548167Z",
"updated_at": "2022-09-04T14:38:50.548188Z",
"structure_string": "Ca1 Si1 N2\n1.0\n1.493659 0.862365 5.297569\n-1.493659 0.862365 5.297569\n0.000000 -1.724729 5.297569\nCa Si N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.499999 0.499999 0.500002 Si\n0.770275 0.770275 0.770279 N\n0.229723 0.229723 0.229725 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Si",
"N"
],
"chemical_system": "Ca-N-Si",
"density": 3.900763189515235,
"density_atomic": 0.09769890693838237,
"volume": 40.942116195043575,
"volume_molar": 6.1639796684707,
"formula_full": "Ca1 Si1 N2",
"formula_reduced": "CaSiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.00688638,
"spacegroup": 166
},
{
"id": "jvasp-115806",
"created_at": "2022-09-04T14:38:50.568215Z",
"updated_at": "2022-09-04T14:38:50.568233Z",
"structure_string": "Ca1 Sn1 N1\n1.0\n3.911293 0.000000 -0.000000\n-0.000000 3.911293 0.000000\n-0.000000 -0.000000 7.195088\nCa Sn N\n1 1 1\ndirect\n0.000000 0.000000 0.280342 Ca\n0.000000 0.000000 0.728025 Sn\n0.000000 0.000000 -0.008034 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"N"
],
"chemical_system": "Ca-N-Sn",
"density": 2.6067699358919847,
"density_atomic": 0.02725489061001764,
"volume": 110.07198828739156,
"volume_molar": 22.095633573324776,
"formula_full": "Ca1 Sn1 N1",
"formula_reduced": "CaSnN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7144517899999998,
"spacegroup": 99
},
{
"id": "jvasp-115807",
"created_at": "2022-09-04T14:38:50.271432Z",
"updated_at": "2022-09-04T14:38:50.271462Z",
"structure_string": "Ca1 Sn1 N1\n1.0\n4.840227 -3.408319 0.000000\n-2.702703 6.426840 0.000000\n0.000000 0.000000 3.797202\nCa Sn N\n1 1 1\ndirect\n0.004784 -0.254409 0.000000 Ca\n-0.027308 0.246358 0.000000 Sn\n0.304845 0.246477 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"N"
],
"chemical_system": "Ca-N-Sn",
"density": 3.451097017242328,
"density_atomic": 0.03608269007341938,
"volume": 83.14235978237042,
"volume_molar": 16.68983312426659,
"formula_full": "Ca1 Sn1 N1",
"formula_reduced": "CaSnN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4700584566666666,
"spacegroup": 25
},
{
"id": "jvasp-115809",
"created_at": "2022-09-04T14:38:39.584178Z",
"updated_at": "2022-09-04T14:38:39.584189Z",
"structure_string": "Ca1 W1 O2\n1.0\n1.559988 0.900660 5.507676\n-1.559988 0.900660 5.507676\n-0.000000 -1.801319 5.507676\nCa W O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 W\n0.251060 0.251060 0.251060 O\n0.748940 0.748940 0.748940 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"W",
"O"
],
"chemical_system": "Ca-O-W",
"density": 9.152638035688678,
"density_atomic": 0.08615061550518745,
"volume": 46.430312500311096,
"volume_molar": 6.990246935191524,
"formula_full": "Ca1 W1 O2",
"formula_reduced": "CaWO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6700693549999994,
"spacegroup": 166
},
{
"id": "jvasp-11581",
"created_at": "2022-09-04T14:37:08.564268Z",
"updated_at": "2022-09-04T14:37:08.564292Z",
"structure_string": "Sr4 Ca1 Cr2 S2 O6\n1.0\n3.913749 -0.000000 -0.000000\n-0.000000 3.913749 0.000000\n0.000000 0.000000 16.538744\nSr Ca Cr S O\n4 1 2 2 6\ndirect\n0.000000 0.500000 0.204120 Sr\n0.500000 0.000000 0.795880 Sr\n0.000000 0.500000 0.417113 Sr\n0.500000 0.000000 0.582887 Sr\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.319981 Cr\n0.000000 0.500000 0.680018 Cr\n0.500000 0.000000 0.113097 S\n0.000000 0.500000 0.886903 S\n0.500000 0.500000 0.302092 O\n0.000000 0.000000 0.301912 O\n0.000000 0.000000 0.698088 O\n0.500000 0.500000 0.697908 O\n0.500000 0.000000 0.434036 O\n0.000000 0.500000 0.565964 O\n",
"nsites": 15,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Cr",
"S",
"O"
],
"chemical_system": "Ca-Cr-O-S-Sr",
"density": 4.291285918501861,
"density_atomic": 0.05921105440049664,
"volume": 253.3310739332854,
"volume_molar": 10.170635907388078,
"formula_full": "Sr4 Ca1 Cr2 S2 O6",
"formula_reduced": "Sr4CaCr2(SO3)2",
"formula_anonymous": "AB2C2D4E6",
"energy_above_hull": 1.9119014306666664,
"spacegroup": 115
},
{
"id": "jvasp-115810",
"created_at": "2022-09-04T14:38:39.974665Z",
"updated_at": "2022-09-04T14:38:39.974686Z",
"structure_string": "Ca1 Y1 O1\n1.0\n3.261800 1.481705 0.000000\n0.434755 7.525519 0.000000\n0.000000 0.000000 3.585789\nCa Y O\n1 1 1\ndirect\n-0.035689 -0.109570 0.000000 Ca\n-0.018794 0.378980 0.000000 Y\n0.282951 0.075375 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Y",
"O"
],
"chemical_system": "Ca-O-Y",
"density": 2.808909810139724,
"density_atomic": 0.03500194042688099,
"volume": 85.70953391189829,
"volume_molar": 17.20516258971483,
"formula_full": "Ca1 Y1 O1",
"formula_reduced": "CaYO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8886564566666666,
"spacegroup": 25
},
{
"id": "jvasp-115813",
"created_at": "2022-09-04T14:38:39.736730Z",
"updated_at": "2022-09-04T14:38:39.736740Z",
"structure_string": "Ca1 Y1 O2\n1.0\n1.687049 0.974018 5.570989\n-1.687049 0.974018 5.570989\n0.000000 -1.948036 5.570989\nCa Y O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Y\n0.250831 0.250831 0.250831 O\n0.749169 0.749169 0.749169 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Y",
"O"
],
"chemical_system": "Ca-O-Y",
"density": 4.866872162123793,
"density_atomic": 0.07282521248436047,
"volume": 54.92603266841161,
"volume_molar": 8.269307502938329,
"formula_full": "Ca1 Y1 O2",
"formula_reduced": "CaYO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0293757174999996,
"spacegroup": 166
},
{
"id": "jvasp-115814",
"created_at": "2022-09-04T14:38:40.187629Z",
"updated_at": "2022-09-04T14:38:40.187656Z",
"structure_string": "Ca1 Y1 O1\n1.0\n3.633003 0.000000 0.000000\n-0.000000 3.633003 -0.000000\n0.000000 -0.000000 7.593344\nCa Y O\n1 1 1\ndirect\n0.000000 0.000000 -0.076142 Ca\n0.000000 0.000000 0.447168 Y\n0.000000 0.000000 0.191978 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Y",
"O"
],
"chemical_system": "Ca-O-Y",
"density": 2.402162263752505,
"density_atomic": 0.029933442557696192,
"volume": 100.22235144579685,
"volume_molar": 20.118436923492602,
"formula_full": "Ca1 Y1 O1",
"formula_reduced": "CaYO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0310864566666669,
"spacegroup": 99
},
{
"id": "jvasp-115815",
"created_at": "2022-09-04T14:38:50.288321Z",
"updated_at": "2022-09-04T14:38:50.288350Z",
"structure_string": "Ca2 Y1 O3\n1.0\n0.000000 7.178831 2.397066\n2.395590 0.000000 2.397066\n2.395590 7.178831 0.000000\nCa Y O\n2 1 3\ndirect\n0.902918 0.566758 0.433242 Ca\n0.566757 0.902919 0.097081 Ca\n0.234866 0.234867 0.765133 Y\n0.399173 0.070523 0.929477 O\n0.070522 0.399174 0.600826 O\n0.734852 0.734854 0.265147 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Y",
"O"
],
"chemical_system": "Ca-O-Y",
"density": 4.371724520465878,
"density_atomic": 0.07277379813177169,
"volume": 82.44725648557996,
"volume_molar": 8.275149730533089,
"formula_full": "Ca2 Y1 O3",
"formula_reduced": "Ca2YO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.1792961316666664,
"spacegroup": 139
}
]
}