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=volume&page=883",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=881",
"results": [
{
"id": "jvasp-99603",
"created_at": "2022-09-04T14:36:39.117373Z",
"updated_at": "2022-09-04T14:36:39.117391Z",
"structure_string": "Ta2 Mo1 Ir1\n1.0\n3.929904 -0.000000 2.268931\n1.309968 3.705149 2.268931\n-0.000000 -0.000000 4.537862\nTa Mo Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ta\n0.750000 0.750000 0.749999 Ta\n0.000000 0.000000 0.000000 Mo\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Mo",
"Ir"
],
"chemical_system": "Ir-Mo-Ta",
"density": 16.336491851416827,
"density_atomic": 0.0605370268639877,
"volume": 66.0752634744856,
"volume_molar": 9.947863434935973,
"formula_full": "Ta2 Mo1 Ir1",
"formula_reduced": "Ta2MoIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.903638849999999,
"spacegroup": 225
},
{
"id": "jvasp-75864",
"created_at": "2022-09-04T14:36:15.671309Z",
"updated_at": "2022-09-04T14:36:15.671337Z",
"structure_string": "Cd1 Tc1 As1\n1.0\n-0.000000 3.208820 3.208820\n3.208820 0.000000 3.208820\n3.208820 3.208820 -0.000000\nCd Tc As\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Cd\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Cd",
"Tc",
"As"
],
"chemical_system": "As-Cd-Tc",
"density": 7.170252143445168,
"density_atomic": 0.045399930860449196,
"volume": 66.07939578633793,
"volume_molar": 13.264647425369263,
"formula_full": "Cd1 Tc1 As1",
"formula_reduced": "CdTcAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.127921,
"spacegroup": 216
},
{
"id": "jvasp-16038",
"created_at": "2022-09-04T14:36:59.721547Z",
"updated_at": "2022-09-04T14:36:59.721559Z",
"structure_string": "Li1 Ni2 P2\n1.0\n3.544967 0.000000 -1.342102\n-0.508111 3.508363 -1.342102\n-0.011222 -0.012965 5.323166\nLi Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.250001 0.750000 0.500001 Ni\n0.750001 0.250000 0.500001 Ni\n0.381753 0.381753 0.763505 P\n0.618249 0.618248 0.236497 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"Ni",
"P"
],
"chemical_system": "Li-Ni-P",
"density": 4.680882202892266,
"density_atomic": 0.07566469597588137,
"volume": 66.08101619272723,
"volume_molar": 7.958983621528854,
"formula_full": "Li1 Ni2 P2",
"formula_reduced": "Li(NiP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.73868516,
"spacegroup": 139
},
{
"id": "jvasp-109555",
"created_at": "2022-09-04T14:38:06.361799Z",
"updated_at": "2022-09-04T14:38:06.361817Z",
"structure_string": "Li1 In2 Ni1\n1.0\n3.930021 0.000000 2.268999\n1.310007 3.705260 2.268999\n0.000000 0.000000 4.537998\nLi In Ni\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750001 In\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"In",
"Ni"
],
"chemical_system": "In-Li-Ni",
"density": 7.419782087666411,
"density_atomic": 0.060531597011952806,
"volume": 66.08119060876825,
"volume_molar": 9.948755785859811,
"formula_full": "Li1 In2 Ni1",
"formula_reduced": "LiIn2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.125763085,
"spacegroup": 225
},
{
"id": "jvasp-16291",
"created_at": "2022-09-04T14:37:58.223801Z",
"updated_at": "2022-09-04T14:37:58.223821Z",
"structure_string": "Te2\n1.0\n3.789054 -0.180098 2.490848\n1.250217 3.581385 2.490848\n-0.266829 -0.180098 4.526595\nTe\n2\ndirect\n0.250000 0.250000 0.250000 Te\n0.749999 0.750000 0.750000 Te\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.412560803835665,
"density_atomic": 0.030264376023591267,
"volume": 66.08429654855556,
"volume_molar": 19.898446792049185,
"formula_full": "Te2",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy_above_hull": 0.0383,
"spacegroup": 221
},
{
"id": "jvasp-25075",
"created_at": "2022-09-04T14:37:55.420941Z",
"updated_at": "2022-09-04T14:37:55.420969Z",
"structure_string": "Te2\n1.0\n3.789056 -0.180093 2.490860\n1.250223 3.581386 2.490860\n-0.266821 -0.180093 4.526603\nTe\n2\ndirect\n0.250000 0.250001 0.250000 Te\n0.750000 0.750002 0.749999 Te\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.412556627840887,
"density_atomic": 0.030264356314791605,
"volume": 66.0843395840706,
"volume_molar": 19.898459750345655,
"formula_full": "Te2",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy_above_hull": 0.0383,
"spacegroup": 221
},
{
"id": "jvasp-40492",
"created_at": "2022-09-04T14:38:13.500585Z",
"updated_at": "2022-09-04T14:38:13.500614Z",
"structure_string": "Sc1 Sn1 Ru2\n1.0\n-0.000000 3.209090 3.209090\n3.209090 -0.000000 3.209090\n3.209090 3.209090 0.000000\nSc Sn Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Sc\n0.750001 0.750001 0.750001 Sn\n0.000000 0.000000 0.000000 Ru\n0.500001 0.500001 0.500001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Sn",
"Ru"
],
"chemical_system": "Ru-Sc-Sn",
"density": 9.190182384154609,
"density_atomic": 0.060517963358205494,
"volume": 66.09607756169886,
"volume_molar": 9.950997069010704,
"formula_full": "Sc1 Sn1 Ru2",
"formula_reduced": "ScSnRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8784594875000007,
"spacegroup": 225
},
{
"id": "jvasp-106034",
"created_at": "2022-09-04T14:36:30.768803Z",
"updated_at": "2022-09-04T14:36:30.768832Z",
"structure_string": "Mn2 Al2 Cu1\n1.0\n2.683183 -0.187868 -7.653134\n-0.255317 2.677607 -7.653134\n0.183199 0.187868 8.107797\nMn Al Cu\n2 2 1\ndirect\n0.808668 0.808670 -0.000001 Mn\n0.394296 0.394297 -0.000000 Mn\n0.587761 0.587763 -0.000000 Al\n0.214067 0.214068 -0.000000 Al\n0.995201 0.995203 -0.000001 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Mn",
"density": 5.711930260843219,
"density_atomic": 0.0756382847605299,
"volume": 66.10409022137338,
"volume_molar": 7.961762722497,
"formula_full": "Mn2 Al2 Cu1",
"formula_reduced": "Mn2Al2Cu",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.430084106551724,
"spacegroup": 107
},
{
"id": "jvasp-75761",
"created_at": "2022-09-04T14:35:50.248233Z",
"updated_at": "2022-09-04T14:35:50.248258Z",
"structure_string": "Si1 As1 P2\n1.0\n0.000000 3.209269 3.209269\n3.209269 -0.000000 3.209269\n3.209269 3.209269 -0.000000\nSi As P\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Si\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 P\n0.250000 0.250000 0.250000 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"As",
"P"
],
"chemical_system": "As-P-Si",
"density": 4.143479865392458,
"density_atomic": 0.06050783758384931,
"volume": 66.10713850841161,
"volume_molar": 9.95266233346178,
"formula_full": "Si1 As1 P2",
"formula_reduced": "SiAsP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0186953375,
"spacegroup": 216
},
{
"id": "jvasp-114619",
"created_at": "2022-09-04T14:38:42.719447Z",
"updated_at": "2022-09-04T14:38:42.719471Z",
"structure_string": "Ag1 Cl1 O1\n1.0\n4.994666 -1.826420 0.000000\n-1.990966 4.655095 0.000000\n0.000000 0.000000 3.370604\nAg Cl O\n1 1 1\ndirect\n0.089166 0.094594 0.000000 Ag\n0.381974 -0.104553 0.000000 Cl\n-0.181576 0.256218 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 4.001661818374197,
"density_atomic": 0.045377504388939505,
"volume": 66.11205354720283,
"volume_molar": 13.271203079797091,
"formula_full": "Ag1 Cl1 O1",
"formula_reduced": "AgClO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7218882758333336,
"spacegroup": 6
},
{
"id": "jvasp-1549",
"created_at": "2022-09-04T14:36:46.108173Z",
"updated_at": "2022-09-04T14:36:46.108198Z",
"structure_string": "Rb1 Tm1 O2\n1.0\n3.327814 0.006644 5.914036\n1.554786 2.942283 5.914036\n0.011001 0.006644 6.786019\nRb Tm O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.499998 0.500002 Tm\n0.775254 0.775250 0.775256 O\n0.224747 0.224746 0.224748 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Tm",
"O"
],
"chemical_system": "O-Rb-Tm",
"density": 7.193365021895773,
"density_atomic": 0.060501863405885065,
"volume": 66.11366617198962,
"volume_molar": 9.953645096184298,
"formula_full": "Rb1 Tm1 O2",
"formula_reduced": "RbTmO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5510178124999998,
"spacegroup": 166
},
{
"id": "jvasp-79555",
"created_at": "2022-09-04T14:37:56.544314Z",
"updated_at": "2022-09-04T14:37:56.544338Z",
"structure_string": "Cr1 Ag1 S2\n1.0\n-1.535857 -2.660185 0.000000\n1.535857 -2.660185 0.000000\n0.000000 -1.773457 8.091677\nCr Ag S\n1 1 2\ndirect\n0.143612 0.143612 0.569165 Cr\n0.977272 0.977272 0.068192 Ag\n0.869687 0.869687 0.390945 S\n0.749435 0.749435 0.751698 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Ag",
"S"
],
"chemical_system": "Ag-Cr-S",
"density": 5.625419425745185,
"density_atomic": 0.06049630303553807,
"volume": 66.11974284858749,
"volume_molar": 9.954559961229933,
"formula_full": "Cr1 Ag1 S2",
"formula_reduced": "CrAgS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.969448665,
"spacegroup": 160
}
]
}