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=-density_atomic&page=852",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=850",
"results": [
{
"id": "jvasp-36651",
"created_at": "2022-09-04T14:37:29.138542Z",
"updated_at": "2022-09-04T14:37:29.138562Z",
"structure_string": "Mn2 Co1 As1\n1.0\n2.872196 2.872196 0.000000\n2.872196 -0.000000 -2.872196\n0.000000 2.872196 -2.872196\nMn Co As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.750001 0.750001 0.750001 Mn\n0.500001 0.500001 0.500001 Co\n0.250000 0.250000 0.250000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Co",
"As"
],
"chemical_system": "As-Co-Mn",
"density": 8.54058163265678,
"density_atomic": 0.0844088097934798,
"volume": 47.38841845758358,
"volume_molar": 7.13449315863376,
"formula_full": "Mn2 Co1 As1",
"formula_reduced": "Mn2CoAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5148317831896545,
"spacegroup": 216
},
{
"id": "jvasp-85361",
"created_at": "2022-09-04T14:35:47.171391Z",
"updated_at": "2022-09-04T14:35:47.171406Z",
"structure_string": "Fe2 Bi2 O6\n1.0\n4.756591 -0.028682 2.779018\n1.581700 4.483403 2.782866\n-0.037508 -0.031656 5.508553\nFe Bi O\n2 2 6\ndirect\n0.298597 0.298568 0.298583 Fe\n0.791132 0.791144 0.791140 Fe\n0.069348 0.069307 0.069362 Bi\n0.565561 0.565473 0.565495 Bi\n0.016522 0.483028 0.611601 O\n0.968572 0.528518 0.100717 O\n0.611572 0.016637 0.483053 O\n0.483000 0.611619 0.016672 O\n0.528557 0.100768 0.968542 O\n0.100760 0.968553 0.528457 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Fe",
"Bi",
"O"
],
"chemical_system": "Bi-Fe-O",
"density": 8.76911536635637,
"density_atomic": 0.08440675047395184,
"volume": 118.47393654949468,
"volume_molar": 7.134667222923657,
"formula_full": "Fe2 Bi2 O6",
"formula_reduced": "FeBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.19070406,
"spacegroup": 146
},
{
"id": "jvasp-15224",
"created_at": "2022-09-04T14:35:46.460573Z",
"updated_at": "2022-09-04T14:35:46.460585Z",
"structure_string": "Y1 Co2 B2\n1.0\n3.345179 -0.000000 -1.189715\n-0.423123 3.318311 -1.189715\n0.010698 0.012149 5.327839\nY Co B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.250001 0.750000 0.500001 Co\n0.750001 0.250000 0.500001 Co\n0.651061 0.651060 0.302122 B\n0.348941 0.348940 0.697881 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Co",
"B"
],
"chemical_system": "B-Co-Y",
"density": 6.402316997806856,
"density_atomic": 0.08440592495734021,
"volume": 59.237547631011225,
"volume_molar": 7.1347370022230825,
"formula_full": "Y1 Co2 B2",
"formula_reduced": "Y(CoB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.805014483333333,
"spacegroup": 139
},
{
"id": "jvasp-46789",
"created_at": "2022-09-04T14:38:05.756115Z",
"updated_at": "2022-09-04T14:38:05.756133Z",
"structure_string": "Li4 Si6 Ni2 O16\n1.0\n0.000000 6.394744 0.127334\n8.114064 0.000000 0.000000\n0.000000 -1.927745 -6.431884\nLi Si Ni O\n4 6 2 16\ndirect\n0.832190 0.680617 0.244995 Li\n0.606230 0.182581 0.545872 Li\n0.393770 0.682581 0.454127 Li\n0.167810 0.180617 0.755005 Li\n0.782897 0.322730 0.933467 Si\n0.805314 0.834789 0.671570 Si\n0.576892 0.974017 0.951201 Si\n0.217104 0.822730 0.066533 Si\n0.423109 0.474017 0.048799 Si\n0.194686 0.334789 0.328430 Si\n0.004505 0.014274 0.365634 Ni\n-0.004504 0.514274 0.634366 Ni\n0.758573 0.683655 0.505944 O\n0.611177 0.166682 0.894485 O\n0.247794 0.409695 0.839178 O\n0.578624 0.863887 0.742162 O\n0.798781 0.359492 0.703493 O\n0.878095 0.012455 0.597727 O\n0.241427 0.183656 0.494056 O\n0.320322 0.974424 0.959710 O\n0.201219 0.859492 0.296507 O\n0.421376 0.363887 0.257838 O\n0.752206 0.909695 0.160822 O\n0.388823 0.666682 0.105515 O\n0.679678 0.474425 0.040290 O\n0.008397 0.265548 0.112384 O\n0.121905 0.512454 0.402273 O\n-0.008396 0.765548 0.887615 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Si",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Si",
"density": 2.851413905537781,
"density_atomic": 0.08440300194098667,
"volume": 331.74175510460145,
"volume_molar": 7.134984090033424,
"formula_full": "Li4 Si6 Ni2 O16",
"formula_reduced": "Li2Si3NiO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.573752585714286,
"spacegroup": 4
},
{
"id": "jvasp-119326",
"created_at": "2022-09-04T14:38:49.472550Z",
"updated_at": "2022-09-04T14:38:49.472578Z",
"structure_string": "Li2 Mn2 F10\n1.0\n5.143933 0.079455 -0.461054\n2.487096 4.622735 1.540519\n-0.010758 -0.088188 7.001369\nLi Mn F\n2 2 10\ndirect\n0.314833 0.297441 0.767203 Li\n0.685168 0.702557 0.232798 Li\n-0.000000 -0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.137674 0.010718 0.256316 F\n0.216663 0.163234 0.562404 F\n0.025789 0.653664 0.126328 F\n0.313162 0.643730 0.629652 F\n0.616304 0.174202 0.013004 F\n0.862327 0.989280 0.743685 F\n0.383697 0.825796 0.986997 F\n0.686839 0.356268 0.370350 F\n0.974212 0.346334 0.873674 F\n0.783338 0.836764 0.437597 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.140748701086163,
"density_atomic": 0.08439938800047402,
"volume": 165.87798006214655,
"volume_molar": 7.135289606562286,
"formula_full": "Li2 Mn2 F10",
"formula_reduced": "LiMnF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.3082069505541869,
"spacegroup": 2
},
{
"id": "jvasp-27505",
"created_at": "2022-09-04T14:36:50.876077Z",
"updated_at": "2022-09-04T14:36:50.876111Z",
"structure_string": "Nd4 B4 O12\n1.0\n5.077419 0.000000 0.000000\n0.000000 5.743499 0.000000\n0.000000 0.000000 8.126031\nNd B O\n4 4 12\ndirect\n0.250000 0.758413 0.084901 Nd\n0.750000 0.241588 0.915099 Nd\n0.250000 0.258412 0.415099 Nd\n0.750000 0.741588 0.584901 Nd\n0.250000 0.916522 0.737043 B\n0.750000 0.083478 0.262957 B\n0.250000 0.416522 0.762957 B\n0.750000 0.583478 0.237043 B\n0.484151 0.412287 0.676815 O\n0.984151 0.587713 0.323185 O\n0.250000 0.900200 0.568548 O\n0.750000 0.099800 0.431452 O\n0.250000 0.400200 0.931452 O\n0.515849 0.587713 0.323185 O\n0.984151 0.087713 0.176815 O\n0.484151 0.912287 0.823185 O\n0.515849 0.087713 0.176815 O\n0.015849 0.412287 0.676815 O\n0.750000 0.599800 0.068548 O\n0.015849 0.912287 0.823185 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"B",
"O"
],
"chemical_system": "B-Nd-O",
"density": 5.6913673856938205,
"density_atomic": 0.08439796348252518,
"volume": 236.9725426389116,
"volume_molar": 7.135410040133138,
"formula_full": "Nd4 B4 O12",
"formula_reduced": "NdBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.1908709166666664,
"spacegroup": 62
},
{
"id": "jvasp-74791",
"created_at": "2022-09-04T14:35:48.562314Z",
"updated_at": "2022-09-04T14:35:48.562331Z",
"structure_string": "Ti1 Be2 V1\n1.0\n-1.745554 1.745554 3.888693\n1.745554 -1.745554 3.888693\n1.745554 1.745554 -3.888693\nTi Be V\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"V"
],
"chemical_system": "Be-Ti-V",
"density": 4.093397251492834,
"density_atomic": 0.08439753541813658,
"volume": 47.39474891277953,
"volume_molar": 7.135446230940382,
"formula_full": "Ti1 Be2 V1",
"formula_reduced": "TiBe2V",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.979003683333333,
"spacegroup": 119
},
{
"id": "jvasp-9476",
"created_at": "2022-09-04T14:38:30.441886Z",
"updated_at": "2022-09-04T14:38:30.441906Z",
"structure_string": "Ca2 Ti2 P2 O10\n1.0\n5.535560 -0.049955 0.007733\n-1.527625 5.326572 0.005198\n-1.616541 -2.132598 6.441040\nCa Ti P O\n2 2 2 10\ndirect\n0.336749 0.167788 0.757262 Ca\n0.669219 0.833352 0.259377 Ca\n0.002961 0.500567 0.508367 Ti\n0.002974 0.500538 0.008367 Ti\n0.682235 0.821873 0.758440 P\n0.323693 0.179237 0.258265 P\n0.671283 0.610038 0.872968 O\n0.894976 0.832974 0.644336 O\n0.334664 0.391072 0.143739 O\n0.110942 0.168148 0.372360 O\n0.593887 0.239892 0.422038 O\n0.264362 0.908759 0.095585 O\n0.412036 0.761237 0.594686 O\n0.741569 0.092336 0.921141 O\n0.922001 0.581170 0.258421 O\n0.083934 0.419935 0.758301 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Ca",
"Ti",
"P",
"O"
],
"chemical_system": "Ca-O-P-Ti",
"density": 3.4846284134387715,
"density_atomic": 0.08439722462727997,
"volume": 189.57969377144983,
"volume_molar": 7.135472507058538,
"formula_full": "Ca2 Ti2 P2 O10",
"formula_reduced": "CaTiPO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.312611469166667,
"spacegroup": 15
},
{
"id": "jvasp-100460",
"created_at": "2022-09-04T14:36:31.496975Z",
"updated_at": "2022-09-04T14:36:31.497003Z",
"structure_string": "Sr2 Fe1 W1 O6\n1.0\n4.774486 0.000000 2.756550\n1.591495 4.501428 2.756550\n0.000000 0.000000 5.513101\nSr Fe W O\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Sr\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 W\n0.249815 0.750184 0.249816 O\n0.750184 0.249816 0.750184 O\n0.249816 0.249816 0.750184 O\n0.750184 0.750184 0.249816 O\n0.249815 0.750184 0.750184 O\n0.750184 0.249816 0.249816 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Fe",
"W",
"O"
],
"chemical_system": "Fe-O-Sr-W",
"density": 7.160285018193575,
"density_atomic": 0.08439702129560889,
"volume": 118.48759407010365,
"volume_molar": 7.135489698039056,
"formula_full": "Sr2 Fe1 W1 O6",
"formula_reduced": "Sr2FeWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.696294912,
"spacegroup": 225
},
{
"id": "jvasp-44050",
"created_at": "2022-09-04T14:36:20.373935Z",
"updated_at": "2022-09-04T14:36:20.373967Z",
"structure_string": "Mn6 O4 F8\n1.0\n3.105796 0.000000 0.000000\n0.000000 4.812293 -0.000000\n0.000000 0.000000 14.270361\nMn O F\n6 4 8\ndirect\n0.000000 0.929597 0.842723 Mn\n0.000000 0.070403 0.157277 Mn\n0.000000 0.000000 0.500000 Mn\n0.500001 0.500000 0.000000 Mn\n0.500001 0.570402 0.342723 Mn\n0.500001 0.429597 0.657277 Mn\n0.500001 0.765672 0.902021 O\n0.000000 0.734327 0.402021 O\n0.500001 0.234327 0.097979 O\n0.000000 0.265672 0.597979 O\n0.500001 0.869059 0.228149 F\n0.500001 0.209116 0.434509 F\n0.500001 0.130941 0.771851 F\n0.000000 0.290883 0.934509 F\n0.000000 0.369059 0.271851 F\n0.000000 0.709116 0.065491 F\n0.000000 0.630940 0.728149 F\n0.500001 0.790883 0.565491 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.247896584257288,
"density_atomic": 0.0843941915672923,
"volume": 213.28482050387998,
"volume_molar": 7.135728950253886,
"formula_full": "Mn6 O4 F8",
"formula_reduced": "Mn3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.981655539348659,
"spacegroup": 58
},
{
"id": "jvasp-34489",
"created_at": "2022-09-04T14:37:16.449025Z",
"updated_at": "2022-09-04T14:37:16.449060Z",
"structure_string": "Sr2 Fe1 W1 O6\n1.0\n5.513573 0.002492 0.005825\n2.753154 4.775366 0.011871\n2.752852 1.582761 4.507449\nSr Fe W O\n2 1 1 6\ndirect\n0.750002 0.750004 0.750000 Sr\n0.249996 0.249997 0.249999 Sr\n0.499999 0.500000 0.499999 Fe\n0.000000 0.000000 0.000000 W\n0.750091 0.249922 0.750347 O\n0.249907 0.750079 0.249652 O\n0.757578 0.742866 0.242413 O\n0.242421 0.257134 0.757586 O\n0.257000 0.757710 0.742731 O\n0.742998 0.242290 0.257268 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Fe",
"W",
"O"
],
"chemical_system": "Fe-O-Sr-W",
"density": 7.159989876078188,
"density_atomic": 0.08439354250735753,
"volume": 118.49247825007686,
"volume_molar": 7.135783830232013,
"formula_full": "Sr2 Fe1 W1 O6",
"formula_reduced": "Sr2FeWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.696289912,
"spacegroup": 87
},
{
"id": "jvasp-74920",
"created_at": "2022-09-04T14:36:16.576092Z",
"updated_at": "2022-09-04T14:36:16.576103Z",
"structure_string": "Be2 Mo1 P1\n1.0\n3.184214 -0.000000 -0.000000\n0.000000 3.184214 0.000000\n0.000000 -0.000000 4.675045\nBe Mo P\n2 1 1\ndirect\n0.000000 0.000000 0.758199 Be\n0.000000 0.000000 0.241802 Be\n0.499999 0.499999 0.000000 Mo\n0.499999 0.499999 0.500001 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Mo",
"P"
],
"chemical_system": "Be-Mo-P",
"density": 5.077400818527998,
"density_atomic": 0.08438586389527769,
"volume": 47.401304144542195,
"volume_molar": 7.136433144150113,
"formula_full": "Be2 Mo1 P1",
"formula_reduced": "Be2MoP",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.1475534,
"spacegroup": 123
}
]
}