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=-spacegroup&page=4370",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4368",
"results": [
{
"id": "jvasp-78503",
"created_at": "2022-09-04T14:37:16.450902Z",
"updated_at": "2022-09-04T14:37:16.450911Z",
"structure_string": "Co1 O2\n1.0\n-2.743824 0.002152 -0.000848\n-1.369988 -2.357779 -0.000272\n-1.370335 0.000744 4.652247\nCo O\n1 2\ndirect\n0.018566 0.002770 0.000004 Co\n0.434661 0.351095 0.759041 O\n0.194373 0.350938 0.240957 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Co",
"O"
],
"chemical_system": "Co-O",
"density": 5.014253686485363,
"density_atomic": 0.09962348736591244,
"volume": 30.11338068282171,
"volume_molar": 6.044900574380575,
"formula_full": "Co1 O2",
"formula_reduced": "CoO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.227339300000001,
"spacegroup": 8
},
{
"id": "jvasp-11031",
"created_at": "2022-09-04T14:37:16.912841Z",
"updated_at": "2022-09-04T14:37:16.912859Z",
"structure_string": "Ca2 Fe4 O8\n1.0\n2.926509 0.001814 0.002209\n1.458984 6.866941 -0.145194\n1.455620 2.486637 7.791117\nCa Fe O\n2 4 8\ndirect\n0.381097 0.086793 0.150834 Ca\n0.612913 0.947338 0.826790 Ca\n0.587353 0.625218 0.199985 Fe\n0.159711 0.216916 0.463563 Fe\n0.842695 0.801743 0.512764 Fe\n0.406351 0.402947 0.784224 Fe\n0.839169 0.589022 0.732535 O\n0.438419 0.752135 0.370912 O\n0.562529 0.289539 0.585328 O\n0.149406 0.432014 0.269056 O\n0.066338 0.807692 0.059567 O\n0.769978 0.104757 0.355140 O\n0.933643 0.223844 0.908714 O\n0.217157 0.945657 0.619929 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-O",
"density": 4.546991021553266,
"density_atomic": 0.08883637606272254,
"volume": 157.59310116517315,
"volume_molar": 6.778913128725663,
"formula_full": "Ca2 Fe4 O8",
"formula_reduced": "Ca(FeO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.354513631428571,
"spacegroup": 8
},
{
"id": "jvasp-11352",
"created_at": "2022-09-04T14:37:17.143493Z",
"updated_at": "2022-09-04T14:37:17.143502Z",
"structure_string": "Ca1 V4 O8\n1.0\n2.972146 0.000088 0.000160\n1.486190 6.573391 -0.281585\n1.485675 0.235487 7.153076\nCa V O\n1 4 8\ndirect\n0.439449 0.054915 0.066045 Ca\n0.638309 0.558753 0.164497 V\n0.150095 0.226398 0.473304 V\n0.818928 0.839105 0.522910 V\n0.334198 0.506773 0.824714 V\n0.815115 0.653958 0.715673 O\n0.448882 0.723750 0.378355 O\n0.527346 0.340412 0.604738 O\n0.165631 0.401517 0.267109 O\n0.119091 0.721592 0.040072 O\n0.801676 0.069508 0.327028 O\n0.852474 0.340852 0.954096 O\n0.184569 0.993118 0.637574 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 4.412121749821734,
"density_atomic": 0.09289376619766289,
"volume": 139.94480504039535,
"volume_molar": 6.482825496800141,
"formula_full": "Ca1 V4 O8",
"formula_reduced": "CaV4O8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.227654247692308,
"spacegroup": 8
},
{
"id": "jvasp-9787",
"created_at": "2022-09-04T14:37:17.234323Z",
"updated_at": "2022-09-04T14:37:17.234340Z",
"structure_string": "Ca4 Sm1 B3 O10\n1.0\n3.562970 -0.004888 0.315843\n1.266981 7.141531 3.664223\n-0.007481 0.002837 9.007595\nCa Sm B O\n4 1 3 10\ndirect\n0.669627 0.528705 0.225815 Ca\n0.340502 0.083530 0.365157 Ca\n0.340502 0.448688 0.634843 Ca\n0.669627 0.754521 0.774185 Ca\n0.000292 0.000078 -0.000000 Sm\n0.914329 0.757916 0.388890 B\n0.296686 0.376923 -0.000000 B\n0.914329 0.146807 0.611110 B\n0.916738 0.947678 0.286988 O\n0.916739 0.234666 0.713012 O\n0.246772 0.537533 0.850386 O\n0.718379 0.700711 0.537798 O\n0.112413 0.966989 0.657449 O\n0.112413 0.624438 0.342551 O\n0.246772 0.387918 0.149614 O\n0.397031 0.203170 -0.000000 O\n0.580395 0.823316 -0.000000 O\n0.718379 0.238511 0.462201 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ca",
"Sm",
"B",
"O"
],
"chemical_system": "B-Ca-O-Sm",
"density": 3.6443519842703513,
"density_atomic": 0.07852180414694179,
"volume": 229.23569059003913,
"volume_molar": 7.669386644161239,
"formula_full": "Ca4 Sm1 B3 O10",
"formula_reduced": "Ca4SmB3O10",
"formula_anonymous": "AB3C4D10",
"energy_above_hull": 2.427649628055556,
"spacegroup": 8
},
{
"id": "jvasp-79748",
"created_at": "2022-09-04T14:37:17.368627Z",
"updated_at": "2022-09-04T14:37:17.368646Z",
"structure_string": "Li1 Ni1 O2\n1.0\n2.986505 0.092534 -0.058012\n-1.410236 2.445850 -0.001121\n-0.105755 -0.062804 4.962164\nLi Ni O\n1 1 2\ndirect\n0.672306 0.336551 0.403006 Li\n0.010222 0.004980 0.970561 Ni\n0.299485 0.649874 0.198490 O\n0.684483 0.341899 0.778744 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 4.396750717196814,
"density_atomic": 0.10847888511178715,
"volume": 36.87353530484769,
"volume_molar": 5.551440498115558,
"formula_full": "Li1 Ni1 O2",
"formula_reduced": "LiNiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.28281235,
"spacegroup": 8
},
{
"id": "jvasp-11614",
"created_at": "2022-09-04T14:37:18.050795Z",
"updated_at": "2022-09-04T14:37:18.050823Z",
"structure_string": "Ti1 Zn1 Bi2 O6\n1.0\n5.398183 -0.028086 0.016817\n-0.027209 5.392722 -0.048774\n-2.666197 -2.726693 4.782102\nTi Zn Bi O\n1 1 2 6\ndirect\n0.215672 0.188729 0.400315 Ti\n0.714899 0.727890 0.444781 Zn\n-0.013138 0.459768 -0.008003 Bi\n0.529500 0.994577 0.994159 Bi\n0.869004 0.969390 0.843499 O\n0.419915 0.372190 0.775068 O\n0.380689 0.888782 0.268720 O\n0.381400 0.388631 0.276554 O\n0.900253 0.400414 0.300281 O\n0.890791 0.898713 0.282710 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ti",
"Zn",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti-Zn",
"density": 7.507762273010029,
"density_atomic": 0.072082921019341,
"volume": 138.72911722482556,
"volume_molar": 8.3544627143844,
"formula_full": "Ti1 Zn1 Bi2 O6",
"formula_reduced": "TiZn(BiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.020802833333333,
"spacegroup": 8
},
{
"id": "jvasp-24624",
"created_at": "2022-09-04T14:37:18.133316Z",
"updated_at": "2022-09-04T14:37:18.133334Z",
"structure_string": "Ag3 P11\n1.0\n6.038661 0.009124 2.785980\n1.754783 6.358517 3.770995\n-0.001264 0.012239 7.598042\nAg P\n3 11\ndirect\n0.017859 0.707295 0.707293 Ag\n0.804041 0.409930 0.409930 Ag\n-0.005695 0.006200 0.006200 Ag\n0.044574 0.190103 0.190102 P\n0.051073 0.507692 0.507691 P\n0.731210 0.917346 0.917346 P\n0.531767 0.733341 0.225053 P\n0.531767 0.225054 0.733340 P\n0.508805 0.387603 0.085187 P\n0.508805 0.085186 0.387603 P\n0.272407 0.393214 0.942194 P\n0.272406 0.942195 0.393213 P\n0.265690 0.650898 0.187942 P\n0.265691 0.187942 0.650898 P\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ag",
"P"
],
"chemical_system": "Ag-P",
"density": 3.7852931507801086,
"density_atomic": 0.04804008381004919,
"volume": 291.4233050749056,
"volume_molar": 12.535658313610742,
"formula_full": "Ag3 P11",
"formula_reduced": "Ag3P11",
"formula_anonymous": "A3B11",
"energy_above_hull": 2.816900162857143,
"spacegroup": 8
},
{
"id": "jvasp-50031",
"created_at": "2022-09-04T14:37:18.068251Z",
"updated_at": "2022-09-04T14:37:18.068265Z",
"structure_string": "Sr2 Ti6 N2 O11\n1.0\n3.849566 -0.002357 -0.000044\n-1.920324 7.512245 0.004905\n-0.000754 -1.496625 9.197391\nSr Ti N O\n2 6 2 11\ndirect\n0.459619 0.916426 0.211459 Sr\n0.553515 0.104223 0.753366 Sr\n0.878354 0.753872 0.900003 Ti\n0.835562 0.668319 0.571837 Ti\n0.768756 0.534729 0.237503 Ti\n0.237550 0.472305 0.768372 Ti\n0.165726 0.328659 0.433542 Ti\n0.123442 0.244110 0.078896 Ti\n0.767533 0.532269 0.751977 N\n0.159822 0.316876 0.902219 N\n0.127937 0.253079 0.612328 O\n0.637636 0.272493 0.124326 O\n0.702378 0.401957 0.429114 O\n0.240644 0.478499 0.244753 O\n0.938956 0.875101 0.711006 O\n0.367410 0.732007 0.897056 O\n0.835529 0.668236 0.091746 O\n0.873485 0.744212 0.382347 O\n0.063717 0.124624 0.307069 O\n0.306000 0.609200 0.566251 O\n-0.000868 0.995476 0.012988 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Sr",
"Ti",
"N",
"O"
],
"chemical_system": "N-O-Sr-Ti",
"density": 4.1609429647302285,
"density_atomic": 0.0789578237620847,
"volume": 265.9647771356654,
"volume_molar": 7.6270348814905065,
"formula_full": "Sr2 Ti6 N2 O11",
"formula_reduced": "Sr2Ti6N2O11",
"formula_anonymous": "A2B2C6D11",
"energy_above_hull": 3.39772322,
"spacegroup": 8
},
{
"id": "jvasp-42309",
"created_at": "2022-09-04T14:37:27.700497Z",
"updated_at": "2022-09-04T14:37:27.700522Z",
"structure_string": "Co6 O8 F4\n1.0\n-4.553869 4.553869 2.917613\n-0.157765 4.398060 -2.920212\n-4.398060 0.157765 -2.920212\nCo O F\n6 8 4\ndirect\n0.846539 0.673605 0.673605 Co\n0.317867 0.657360 0.657360 Co\n0.651974 0.338655 0.338655 Co\n0.177268 0.338162 0.338162 Co\n0.497364 0.997217 0.997217 Co\n0.997687 0.989662 0.989662 Co\n0.002579 0.696569 0.302712 O\n0.002579 0.302712 0.696569 O\n0.668948 0.638860 0.034382 O\n0.333904 0.969354 0.361798 O\n0.366237 0.435537 0.435537 O\n0.668948 0.034382 0.638860 O\n0.333904 0.361798 0.969354 O\n0.038032 0.765169 0.765169 O\n0.964206 0.231995 0.231995 F\n0.632214 0.577609 0.577609 F\n0.308642 0.893654 0.893654 F\n0.691119 0.097703 0.097703 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.474153652335472,
"density_atomic": 0.10642091428826336,
"volume": 169.13968575052104,
"volume_molar": 5.658794420510022,
"formula_full": "Co6 O8 F4",
"formula_reduced": "Co3(O2F)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.3747374738888887,
"spacegroup": 8
},
{
"id": "jvasp-9990",
"created_at": "2022-09-04T14:37:19.075687Z",
"updated_at": "2022-09-04T14:37:19.075717Z",
"structure_string": "Ca5 B3 O9 F1\n1.0\n3.525148 -0.006944 0.298694\n1.208405 7.182976 3.687086\n-0.012725 0.000763 9.040983\nCa B O F\n5 3 9 1\ndirect\n0.642307 0.204606 -0.000000 Ca\n0.347434 0.698611 0.235476 Ca\n0.347434 0.934087 0.764523 Ca\n0.006099 0.261624 0.356638 Ca\n0.006099 0.618262 0.643362 Ca\n0.591630 0.319928 0.608045 B\n0.591631 0.927974 0.391954 B\n0.965346 0.558531 -0.000001 B\n0.793851 0.141587 0.653693 O\n0.918697 0.571261 0.148460 O\n0.581594 0.406465 0.709741 O\n0.403428 0.408596 0.456442 O\n0.403429 0.865038 0.543558 O\n0.581595 0.116206 0.290259 O\n0.056680 0.386709 0.000000 O\n0.918696 0.719720 0.851539 O\n0.793852 0.795282 0.346306 O\n0.247802 -0.000881 -0.000000 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ca",
"B",
"O",
"F"
],
"chemical_system": "B-Ca-F-O",
"density": 2.8699016787413947,
"density_atomic": 0.07859539062943194,
"volume": 229.02106415970235,
"volume_molar": 7.662206029859549,
"formula_full": "Ca5 B3 O9 F1",
"formula_reduced": "Ca5B3O9F",
"formula_anonymous": "AB3C5D9",
"energy_above_hull": 2.110897868472222,
"spacegroup": 8
},
{
"id": "jvasp-11032",
"created_at": "2022-09-04T14:37:19.583955Z",
"updated_at": "2022-09-04T14:37:19.584001Z",
"structure_string": "V4 Zn1 O8\n1.0\n2.894830 0.002584 0.003006\n1.440494 7.167398 -0.017943\n1.438720 0.995537 7.250005\nV Zn O\n4 1 8\ndirect\n0.368736 0.822755 0.428558 V\n0.852158 0.492459 0.791990 V\n0.157750 0.509071 0.164176 V\n0.641012 0.196181 0.510590 V\n0.652372 0.872154 0.811925 Zn\n0.140325 0.328838 0.379309 O\n0.535221 0.664438 0.253866 O\n0.463453 0.358901 0.702934 O\n0.854396 0.695059 0.584903 O\n0.823481 0.990693 0.351154 O\n0.202821 0.675808 0.907339 O\n0.156962 0.022074 0.652809 O\n0.777355 0.389987 0.044018 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"V",
"Zn",
"O"
],
"chemical_system": "O-V-Zn",
"density": 4.3843853767381225,
"density_atomic": 0.08642239941995941,
"volume": 150.42396516704008,
"volume_molar": 6.968263783948093,
"formula_full": "V4 Zn1 O8",
"formula_reduced": "V4ZnO8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.1442042461538464,
"spacegroup": 8
},
{
"id": "jvasp-30374",
"created_at": "2022-09-04T14:37:19.713120Z",
"updated_at": "2022-09-04T14:37:19.713140Z",
"structure_string": "V3 Fe3 Te2 O16\n1.0\n5.585256 -0.025618 -0.064148\n-2.814059 4.874157 0.004245\n-0.120425 -0.074350 10.605504\nV Fe Te O\n3 3 2 16\ndirect\n0.637655 0.819074 0.235294 V\n0.803197 0.640422 0.721777 V\n0.804783 0.163709 0.722753 V\n0.176218 0.820763 0.213331 Fe\n0.176263 0.355935 0.213344 Fe\n0.362695 0.181061 0.705766 Fe\n0.312372 0.656075 0.509749 Te\n0.665697 0.333142 0.018330 Te\n0.843056 0.679790 0.109890 O\n0.683320 0.341045 0.604813 O\n0.509736 0.009365 0.816059 O\n0.509362 0.499797 0.815794 O\n0.666941 0.833189 0.603962 O\n0.330624 0.165620 0.118071 O\n0.497312 0.514498 0.326003 O\n0.007269 0.003785 0.296441 O\n0.164155 0.322543 0.610345 O\n0.009330 0.004468 0.792021 O\n0.970045 0.484860 0.817643 O\n0.347525 0.674078 0.111060 O\n0.017897 0.509095 0.306810 O\n0.164131 0.840905 0.610594 O\n0.497324 0.983147 0.325961 O\n0.843110 0.163837 0.109895 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"V",
"Fe",
"Te",
"O"
],
"chemical_system": "Fe-O-Te-V",
"density": 4.7961134384565645,
"density_atomic": 0.08336106897434105,
"volume": 287.9041775170532,
"volume_molar": 7.22416450999884,
"formula_full": "V3 Fe3 Te2 O16",
"formula_reduced": "V3Fe3(TeO8)2",
"formula_anonymous": "A2B3C3D16",
"energy_above_hull": 3.3192696097222223,
"spacegroup": 8
}
]
}