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=created_at&page=1279",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=1277",
"results": [
{
"id": "jvasp-99441",
"created_at": "2022-09-04T14:36:31.713909Z",
"updated_at": "2022-09-04T14:36:31.713936Z",
"structure_string": "Si2 Ag4 P4\n1.0\n5.640799 -0.002978 -2.888122\n-2.110181 5.231229 -2.888122\n0.002011 0.002978 6.337180\nSi Ag P\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Si\n0.750000 0.250000 0.500000 Si\n0.375000 0.676419 0.801419 Ag\n0.875000 0.573581 0.198582 Ag\n0.323582 0.125000 0.698582 Ag\n0.426419 0.625000 0.301419 Ag\n0.375000 0.295666 0.420667 P\n0.875000 0.954334 0.579334 P\n0.704334 0.125000 0.079334 P\n0.045667 0.625001 0.920667 P\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Si",
"Ag",
"P"
],
"chemical_system": "Ag-P-Si",
"density": 5.428749834216454,
"density_atomic": 0.0534597201317553,
"volume": 187.05672187123847,
"volume_molar": 11.264819092127686,
"formula_full": "Si2 Ag4 P4",
"formula_reduced": "Si(AgP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.8060948239999997,
"spacegroup": 122
},
{
"id": "jvasp-100261",
"created_at": "2022-09-04T14:36:31.716910Z",
"updated_at": "2022-09-04T14:36:31.716927Z",
"structure_string": "Yb3 Pb1\n1.0\n4.899338 0.000000 -0.000000\n0.000000 4.899338 0.000000\n-0.000000 0.000000 4.899338\nYb Pb\n3 1\ndirect\n0.000000 0.500000 0.500000 Yb\n0.500000 0.000000 0.500000 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Pb"
],
"chemical_system": "Pb-Yb",
"density": 10.255690228424129,
"density_atomic": 0.0340132229143463,
"volume": 117.6013225818967,
"volume_molar": 17.70529295375871,
"formula_full": "Yb3 Pb1",
"formula_reduced": "Yb3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0046999999999999,
"spacegroup": 221
},
{
"id": "jvasp-96831",
"created_at": "2022-09-04T14:36:31.720365Z",
"updated_at": "2022-09-04T14:36:31.720381Z",
"structure_string": "Pr10 C4 Cl18\n1.0\n8.527577 0.014450 0.699914\n4.110144 7.563865 0.782627\n0.019377 -0.020308 11.902343\nPr C Cl\n10 4 18\ndirect\n0.132374 0.272123 0.271466 Pr\n0.769202 0.071717 0.257234 Pr\n0.793772 0.316371 0.507014 Pr\n0.206228 0.683628 0.492986 Pr\n0.603673 0.600717 0.216333 Pr\n0.396328 0.399282 0.783666 Pr\n0.230799 0.928282 0.742766 Pr\n0.898578 0.294933 0.993736 Pr\n0.101423 0.705066 0.006263 Pr\n0.867627 0.727876 0.728534 Pr\n0.141238 0.699660 0.810049 C\n0.172275 0.688738 0.690212 C\n0.858763 0.300340 0.189951 C\n0.827726 0.311261 0.309787 C\n0.838305 0.134735 0.743680 Cl\n0.822239 0.946356 0.495785 Cl\n0.500000 0.500000 -0.000000 Cl\n0.083673 0.338702 0.768508 Cl\n0.543424 0.677424 0.449113 Cl\n0.775607 0.041345 0.019951 Cl\n0.177762 0.053643 0.504215 Cl\n0.485899 0.984906 0.228364 Cl\n0.397330 0.409523 0.276341 Cl\n0.224393 0.958654 0.980049 Cl\n0.219271 0.330404 0.030788 Cl\n0.602670 0.590476 0.723659 Cl\n0.916328 0.661297 0.231492 Cl\n0.780730 0.669595 0.969212 Cl\n0.000000 0.500000 0.500000 Cl\n0.161696 0.865264 0.256320 Cl\n0.514102 0.015093 0.771635 Cl\n0.456577 0.322575 0.550887 Cl\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Pr",
"C",
"Cl"
],
"chemical_system": "C-Cl-Pr",
"density": 4.536305215968716,
"density_atomic": 0.041721745493079374,
"volume": 766.9861273016016,
"volume_molar": 14.434057561179765,
"formula_full": "Pr10 C4 Cl18",
"formula_reduced": "Pr5C2Cl9",
"formula_anonymous": "A2B5C9",
"energy_above_hull": 1.54830099109375,
"spacegroup": 2
},
{
"id": "jvasp-93713",
"created_at": "2022-09-04T14:36:31.725419Z",
"updated_at": "2022-09-04T14:36:31.725445Z",
"structure_string": "Hf1 Ta2 N3\n1.0\n5.256220 -0.000413 0.000000\n-2.628467 4.551814 0.000000\n0.000000 0.000000 2.990670\nHf Ta N\n1 2 3\ndirect\n0.000018 0.000018 0.000000 Hf\n0.666684 0.333357 0.500000 Ta\n0.333356 0.666684 0.500000 Ta\n0.500007 0.500007 0.000000 N\n0.500016 0.000019 0.000000 N\n0.000019 0.500015 0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Ta",
"N"
],
"chemical_system": "Hf-N-Ta",
"density": 13.516616849882645,
"density_atomic": 0.08385798449601194,
"volume": 71.54953742401648,
"volume_molar": 7.181356428005251,
"formula_full": "Hf1 Ta2 N3",
"formula_reduced": "HfTa2N3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 6.172678525,
"spacegroup": 191
},
{
"id": "jvasp-43857",
"created_at": "2022-09-04T14:36:31.730974Z",
"updated_at": "2022-09-04T14:36:31.730993Z",
"structure_string": "Li4 V2 O4 F2\n1.0\n0.000000 5.093422 -0.045584\n2.879323 0.000000 0.000000\n0.000000 0.029730 -7.201421\nLi V O F\n4 2 4 2\ndirect\n0.581303 0.250000 0.838566 Li\n0.236464 0.250000 0.487451 Li\n0.418696 0.749999 0.161433 Li\n0.763535 0.749999 0.512548 Li\n0.063987 0.749999 0.832675 V\n0.936012 0.250000 0.167324 V\n0.241035 0.250000 0.992384 O\n0.758964 0.749999 0.007616 O\n0.076418 0.749999 0.323907 O\n0.923582 0.250000 0.676092 O\n0.410741 0.749999 0.665974 F\n0.589259 0.250000 0.334025 F\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.6421941265922646,
"density_atomic": 0.11362634714082999,
"volume": 105.60930894950836,
"volume_molar": 5.299951033835558,
"formula_full": "Li4 V2 O4 F2",
"formula_reduced": "Li2VO2F",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 1.4907485804166671,
"spacegroup": 11
},
{
"id": "jvasp-51448",
"created_at": "2022-09-04T14:36:31.734268Z",
"updated_at": "2022-09-04T14:36:31.734287Z",
"structure_string": "Nd3 Ga1 N1\n1.0\n5.466882 -0.000000 0.000000\n0.000000 5.466882 -0.000000\n-0.000000 -0.000000 5.466882\nNd Ga N\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Nd\n0.000000 0.500000 0.500000 Nd\n0.500000 0.500000 0.000000 Nd\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Ga",
"N"
],
"chemical_system": "Ga-N-Nd",
"density": 5.248836835719391,
"density_atomic": 0.030602077062852295,
"volume": 163.3876024078599,
"volume_molar": 19.678862802780944,
"formula_full": "Nd3 Ga1 N1",
"formula_reduced": "Nd3GaN",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.235256015,
"spacegroup": 221
},
{
"id": "jvasp-77171",
"created_at": "2022-09-04T14:36:31.734515Z",
"updated_at": "2022-09-04T14:36:31.734541Z",
"structure_string": "Ba2 In1 Hg1\n1.0\n-18.757130 -3.553978 -7.927625\n-11.287193 -2.257414 -1.604732\n-9.241689 1.209069 -3.254131\nBa In Hg\n2 1 1\ndirect\n0.846070 0.806996 0.193006 Ba\n0.153928 0.193006 0.806995 Ba\n0.000000 0.000000 0.000000 In\n0.500000 0.000001 -0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"In",
"Hg"
],
"chemical_system": "Ba-Hg-In",
"density": 5.528655335397726,
"density_atomic": 0.022570062572947205,
"volume": 177.22591539442413,
"volume_molar": 26.681985220626828,
"formula_full": "Ba2 In1 Hg1",
"formula_reduced": "Ba2InHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.099295,
"spacegroup": 71
},
{
"id": "jvasp-8616",
"created_at": "2022-09-04T14:36:31.735215Z",
"updated_at": "2022-09-04T14:36:31.735229Z",
"structure_string": "Sr2 Co1 Br2 O2\n1.0\n3.813710 0.000000 -0.922195\n-0.222997 3.807186 -0.922195\n0.272452 0.288876 9.473551\nSr Co Br O\n2 1 2 2\ndirect\n0.596330 0.596329 0.192658 Sr\n0.403669 0.403672 0.807342 Sr\n0.000000 0.000000 0.000000 Co\n0.178426 0.178427 0.356851 Br\n0.821573 0.821574 0.643147 Br\n0.500001 0.000000 -0.000000 O\n0.999999 0.500001 -0.000001 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sr",
"Co",
"Br",
"O"
],
"chemical_system": "Br-Co-O-Sr",
"density": 5.067632796178318,
"density_atomic": 0.05014930013412299,
"volume": 139.58320417789847,
"volume_molar": 12.008424332730351,
"formula_full": "Sr2 Co1 Br2 O2",
"formula_reduced": "Sr2Co(BrO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.8075226757142857,
"spacegroup": 139
},
{
"id": "jvasp-50113",
"created_at": "2022-09-04T14:36:31.739796Z",
"updated_at": "2022-09-04T14:36:31.739833Z",
"structure_string": "Li4 Hf2 O6\n1.0\n2.680434 4.492976 0.014371\n-2.680434 4.492976 -0.014371\n-2.046486 0.000000 4.957371\nLi Hf O\n4 2 6\ndirect\n0.566257 0.583816 0.491682 Li\n0.250816 0.267750 0.491198 Li\n0.416184 0.433744 0.991682 Li\n0.732251 0.749185 0.991198 Li\n0.900136 0.917170 0.491198 Hf\n0.082831 0.099865 0.991198 Hf\n0.297770 0.853776 0.753977 O\n0.146225 0.702230 0.253977 O\n0.991424 0.508559 0.741270 O\n0.685356 0.163095 0.728476 O\n0.491442 0.008576 0.241270 O\n0.836906 0.314644 0.228476 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Hf",
"O"
],
"chemical_system": "Hf-Li-O",
"density": 6.670815421519764,
"density_atomic": 0.10027679670671374,
"volume": 119.6687608111097,
"volume_molar": 6.005517684827287,
"formula_full": "Li4 Hf2 O6",
"formula_reduced": "Li2HfO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.099910583333334,
"spacegroup": 15
},
{
"id": "jvasp-15681",
"created_at": "2022-09-04T14:36:31.749963Z",
"updated_at": "2022-09-04T14:36:31.749979Z",
"structure_string": "Co1 Cu2 Ge1 S4\n1.0\n4.805630 -0.000183 -2.168951\n-0.978964 4.704840 -2.168937\n0.024435 0.030060 6.463122\nCo Cu Ge S\n1 2 1 4\ndirect\n0.999985 0.999981 0.999989 Co\n0.249996 0.749992 0.499986 Cu\n0.749990 0.249998 0.499996 Cu\n0.499996 0.499997 0.000006 Ge\n0.631005 0.120066 0.751055 S\n0.120066 0.631004 0.751050 S\n0.369012 0.369011 0.248955 S\n0.879950 0.879954 0.248962 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Co",
"Cu",
"Ge",
"S"
],
"chemical_system": "Co-Cu-Ge-S",
"density": 4.378083194324371,
"density_atomic": 0.05451272464037526,
"volume": 146.7547265849695,
"volume_molar": 11.047220258625005,
"formula_full": "Co1 Cu2 Ge1 S4",
"formula_reduced": "CoCu2GeS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.5310122187500002,
"spacegroup": 121
},
{
"id": "jvasp-15750",
"created_at": "2022-09-04T14:36:31.762575Z",
"updated_at": "2022-09-04T14:36:31.762602Z",
"structure_string": "Sc1 Ru3 C1\n1.0\n4.078503 0.000000 -0.000000\n0.000000 4.078503 0.000000\n-0.000000 0.000000 4.078503\nSc Ru C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Ru\n0.500000 0.000000 0.500000 Ru\n0.500000 0.500000 0.000000 Ru\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"C"
],
"chemical_system": "C-Ru-Sc",
"density": 8.815810530579585,
"density_atomic": 0.07370002684542344,
"volume": 67.84258044419539,
"volume_molar": 8.17115137913136,
"formula_full": "Sc1 Ru3 C1",
"formula_reduced": "ScRu3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.65735935,
"spacegroup": 221
},
{
"id": "jvasp-7805",
"created_at": "2022-09-04T14:36:31.763231Z",
"updated_at": "2022-09-04T14:36:31.763261Z",
"structure_string": "Tm1 Mg1\n1.0\n3.720649 0.000000 -0.000000\n0.000000 3.720649 -0.000000\n0.000000 0.000000 3.720649\nTm Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm",
"density": 6.23000287180799,
"density_atomic": 0.03883058126991655,
"volume": 51.50579606567651,
"volume_molar": 15.50875769316791,
"formula_full": "Tm1 Mg1",
"formula_reduced": "TmMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.5105814739583332,
"spacegroup": 221
}
]
}