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=elements&page=4352",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4350",
"results": [
{
"id": "jvasp-117266",
"created_at": "2022-09-04T14:38:49.753019Z",
"updated_at": "2022-09-04T14:38:49.753034Z",
"structure_string": "Na4 Ni4 As4 O16\n1.0\n4.978145 0.000028 -0.000006\n-0.000096 8.841509 -2.874159\n0.000084 0.000051 8.622656\nNa Ni As O\n4 4 4 16\ndirect\n0.500001 0.139886 0.213265 Na\n0.000000 0.139886 0.713264 Na\n0.499998 0.860114 0.786736 Na\n-0.000002 0.860114 0.286735 Na\n0.499999 0.506797 0.335600 Ni\n0.000001 0.493203 0.164400 Ni\n-0.000001 0.506796 0.835600 Ni\n0.500000 0.493204 0.664401 Ni\n-0.000004 0.698929 0.566310 As\n0.499996 0.698928 0.066312 As\n0.000004 0.301072 0.433688 As\n0.500003 0.301071 0.933690 As\n0.825235 0.637646 0.711252 O\n0.325235 0.637645 0.211250 O\n0.174764 0.362355 0.288749 O\n0.674764 0.362354 0.788747 O\n0.160663 0.362366 0.624182 O\n0.660665 0.362366 0.124179 O\n0.335431 0.637640 0.550579 O\n0.000003 0.110572 0.370211 O\n0.664567 0.362360 0.449422 O\n0.164567 0.362360 0.949421 O\n0.999996 0.889429 0.629791 O\n0.499996 0.889428 0.129789 O\n0.339336 0.637633 0.875819 O\n0.500004 0.110571 0.870209 O\n0.835433 0.637641 0.050578 O\n0.839336 0.637635 0.375820 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Ni",
"As",
"O"
],
"chemical_system": "As-Na-Ni-O",
"density": 3.860854456859723,
"density_atomic": 0.07377720535777493,
"volume": 379.52101688071394,
"volume_molar": 8.162603517978555,
"formula_full": "Na4 Ni4 As4 O16",
"formula_reduced": "NaNiAsO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.81013245,
"spacegroup": 148
},
{
"id": "jvasp-43409",
"created_at": "2022-09-04T14:38:06.319184Z",
"updated_at": "2022-09-04T14:38:06.319214Z",
"structure_string": "Na2 Ni2 B2 O6\n1.0\n4.998981 -0.030014 0.017618\n-2.467402 -4.349129 -0.106328\n-1.097927 -0.112435 -5.439037\nNa Ni B O\n2 2 2 6\ndirect\n0.653126 0.320331 0.746012 Na\n0.343804 0.674248 0.250688 Na\n0.998451 0.997291 0.498367 Ni\n0.998439 0.997258 0.998363 Ni\n0.323416 0.657208 0.746887 B\n0.673471 0.337355 0.249811 B\n0.128795 0.344327 0.728365 O\n0.868082 0.650234 0.268355 O\n0.627790 0.782848 0.707035 O\n0.213305 0.842014 0.806428 O\n0.783616 0.152585 0.190271 O\n0.369098 0.211704 0.289660 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Na",
"Ni",
"B",
"O"
],
"chemical_system": "B-Na-Ni-O",
"density": 3.937051857109061,
"density_atomic": 0.10125594974003556,
"volume": 118.5115544400975,
"volume_molar": 5.947443854372251,
"formula_full": "Na2 Ni2 B2 O6",
"formula_reduced": "NaNiBO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.929634080555556,
"spacegroup": 2
},
{
"id": "jvasp-109216",
"created_at": "2022-09-04T14:38:18.764483Z",
"updated_at": "2022-09-04T14:38:18.764508Z",
"structure_string": "Na1 Ni1 I1 O6\n1.0\n5.003589 -0.000000 0.000000\n-2.501795 4.333235 0.000000\n0.000000 0.000000 5.091185\nNa Ni I O\n1 1 1 6\ndirect\n0.333333 0.666667 -0.000000 Na\n0.666667 0.333334 0.500000 Ni\n0.000000 0.000000 0.500000 I\n0.337594 0.041255 0.709221 O\n0.958745 0.662407 0.290778 O\n0.337594 0.296339 0.290778 O\n0.703662 0.041255 0.290778 O\n0.958745 0.296339 0.709221 O\n0.703661 0.662407 0.709221 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Na",
"Ni",
"I",
"O"
],
"chemical_system": "I-Na-Ni-O",
"density": 4.581877665034382,
"density_atomic": 0.08153231235237617,
"volume": 110.38568317678416,
"volume_molar": 7.386201355326202,
"formula_full": "Na1 Ni1 I1 O6",
"formula_reduced": "NaNiIO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 1.809716519444444,
"spacegroup": 149
},
{
"id": "jvasp-57245",
"created_at": "2022-09-04T14:37:14.288561Z",
"updated_at": "2022-09-04T14:37:14.288583Z",
"structure_string": "Na1 Ni1 I1 O6\n1.0\n5.006399 -0.000028 -0.000016\n-2.503223 4.335739 0.000032\n-0.000026 0.000030 5.127134\nNa Ni I O\n1 1 1 6\ndirect\n0.000001 0.000001 0.000000 Na\n0.333339 0.666666 0.500001 Ni\n0.666666 0.333329 0.499997 I\n0.003542 0.374361 0.707284 O\n0.625639 0.996456 0.292718 O\n0.003544 0.629184 0.292715 O\n0.370817 0.374360 0.292716 O\n0.625637 0.629188 0.707280 O\n0.370817 0.996457 0.707282 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Na",
"Ni",
"I",
"O"
],
"chemical_system": "I-Na-Ni-O",
"density": 4.544586599916564,
"density_atomic": 0.08086873575967464,
"volume": 111.2914640677228,
"volume_molar": 7.446809577803433,
"formula_full": "Na1 Ni1 I1 O6",
"formula_reduced": "NaNiIO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 1.8112009638888888,
"spacegroup": 149
},
{
"id": "jvasp-43660",
"created_at": "2022-09-04T14:36:13.421364Z",
"updated_at": "2022-09-04T14:36:13.421386Z",
"structure_string": "Na4 Ni4 P4 O16\n1.0\n4.957976 -0.000000 0.000000\n-0.000000 6.137619 0.000000\n0.000000 0.000000 10.117489\nNa Ni P O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.511602 0.250000 0.219841 Ni\n0.011601 0.750000 0.280159 Ni\n0.988400 0.250000 0.719841 Ni\n0.488399 0.750000 0.780159 Ni\n0.439958 0.250000 0.892300 P\n0.939958 0.750000 0.607700 P\n0.060043 0.250000 0.392300 P\n0.560043 0.750000 0.107700 P\n0.303934 0.050931 0.820554 O\n0.303934 0.449069 0.820554 O\n0.803935 0.550931 0.679446 O\n0.803935 0.949069 0.679446 O\n0.249338 0.750000 0.613287 O\n0.159855 0.250000 0.537776 O\n0.840146 0.750000 0.462224 O\n0.250663 0.750000 0.113287 O\n0.196066 0.050931 0.320554 O\n0.196066 0.449069 0.320554 O\n0.696067 0.550931 0.179446 O\n0.696067 0.949069 0.179446 O\n0.749338 0.250000 0.886713 O\n0.340146 0.250000 0.037776 O\n0.750663 0.250000 0.386713 O\n0.659855 0.750000 0.962224 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Ni",
"P",
"O"
],
"chemical_system": "Na-Ni-O-P",
"density": 3.811156509665747,
"density_atomic": 0.09094544340787679,
"volume": 307.87688696424476,
"volume_molar": 6.621706964461754,
"formula_full": "Na4 Ni4 P4 O16",
"formula_reduced": "NaNiPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8412258428571429,
"spacegroup": 62
},
{
"id": "jvasp-48488",
"created_at": "2022-09-04T14:35:58.103670Z",
"updated_at": "2022-09-04T14:35:58.103690Z",
"structure_string": "Na2 Ni2 P2 O8\n1.0\n2.655590 4.182965 -0.000000\n-2.655590 4.182965 -0.000000\n0.000000 -0.000000 6.702768\nNa Ni P O\n2 2 2 8\ndirect\n0.312594 0.312594 0.750000 Na\n0.687407 0.687407 0.250000 Na\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.337514 0.337514 0.250000 P\n0.662487 0.662487 0.750000 P\n0.209647 0.689332 0.250000 O\n0.310669 0.790354 0.750000 O\n0.232765 0.232765 0.436521 O\n0.767236 0.767236 0.563480 O\n0.232765 0.232765 0.063479 O\n0.767236 0.767236 0.936521 O\n0.790354 0.310669 0.750000 O\n0.689332 0.209647 0.250000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Na",
"Ni",
"P",
"O"
],
"chemical_system": "Na-Ni-O-P",
"density": 3.939802362922704,
"density_atomic": 0.09401531318031096,
"volume": 148.9119115430648,
"volume_molar": 6.4054892296643215,
"formula_full": "Na2 Ni2 P2 O8",
"formula_reduced": "NaNiPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.841311557142857,
"spacegroup": 63
},
{
"id": "jvasp-7865",
"created_at": "2022-09-04T14:36:42.394082Z",
"updated_at": "2022-09-04T14:36:42.394103Z",
"structure_string": "Na5 Ni1 S1 O2\n1.0\n4.559796 0.000000 0.000000\n-0.000000 4.559805 0.000000\n0.000000 0.000000 8.066949\nNa Ni S O\n5 1 1 2\ndirect\n0.000000 0.500001 0.255003 Na\n0.500000 0.000000 0.255099 Na\n0.000000 0.500001 0.744997 Na\n0.500000 0.000000 0.744901 Na\n0.000000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500001 0.500000 S\n0.000000 0.000000 0.780120 O\n0.000000 0.000000 0.219880 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Na",
"Ni",
"S",
"O"
],
"chemical_system": "Na-Ni-O-S",
"density": 2.3533598034448597,
"density_atomic": 0.05365886898260935,
"volume": 167.72623371761466,
"volume_molar": 11.22301098435704,
"formula_full": "Na5 Ni1 S1 O2",
"formula_reduced": "Na5NiSO2",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 0.4179715999999998,
"spacegroup": 123
},
{
"id": "jvasp-39525",
"created_at": "2022-09-04T14:37:46.263631Z",
"updated_at": "2022-09-04T14:37:46.263646Z",
"structure_string": "Na3 Ni2 Sb1 O6\n1.0\n5.292511 -0.001444 -0.846902\n-2.847360 4.461302 -0.846902\n0.001112 0.002028 5.610495\nNa Ni Sb O\n3 2 1 6\ndirect\n0.500000 0.499999 0.500000 Na\n0.176248 0.823751 0.500001 Na\n0.823751 0.176250 0.500001 Na\n0.333825 0.666175 1.000000 Ni\n0.666175 0.333826 1.000000 Ni\n0.000000 0.000000 0.000000 Sb\n0.068305 0.389467 0.205239 O\n0.252090 0.252089 0.793541 O\n0.747910 0.747910 0.206461 O\n0.389466 0.068305 0.205239 O\n0.610534 0.931695 0.794761 O\n0.931694 0.610535 0.794761 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Na",
"Ni",
"Sb",
"O"
],
"chemical_system": "Na-Ni-O-Sb",
"density": 5.065739265680969,
"density_atomic": 0.09058842078902658,
"volume": 132.4672612181536,
"volume_molar": 6.64780410956175,
"formula_full": "Na3 Ni2 Sb1 O6",
"formula_reduced": "Na3Ni2SbO6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 1.5047024083333334,
"spacegroup": 12
},
{
"id": "jvasp-96962",
"created_at": "2022-09-04T14:36:41.606163Z",
"updated_at": "2022-09-04T14:36:41.606193Z",
"structure_string": "Na2 Np2 C2 O10\n1.0\n4.382254 0.000001 0.000027\n0.000002 4.893038 -0.000000\n0.000052 0.000000 10.391503\nNa Np C O\n2 2 2 10\ndirect\n0.785137 0.500000 0.245259 Na\n0.214868 0.000000 0.745260 Na\n0.273846 0.500001 0.502761 Np\n0.726149 -0.000001 0.002763 Np\n0.342899 0.499999 0.999023 C\n0.657101 -0.000000 0.499023 C\n0.214665 0.265496 0.989187 O\n0.785332 0.234504 0.489188 O\n0.744162 -0.000000 0.181386 O\n0.255823 0.500000 0.681382 O\n0.284239 0.500000 0.322836 O\n0.362025 -0.000000 0.520360 O\n0.785331 0.765497 0.489188 O\n0.637977 0.500000 0.020362 O\n0.715765 -0.000000 0.822835 O\n0.214665 0.734504 0.989187 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Na",
"Np",
"C",
"O"
],
"chemical_system": "C-Na-Np-O",
"density": 5.246433014314892,
"density_atomic": 0.07180678469231033,
"volume": 222.82017038584118,
"volume_molar": 8.386590188941993,
"formula_full": "Na2 Np2 C2 O10",
"formula_reduced": "NaNpCO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 3.2681470625000006,
"spacegroup": 31
},
{
"id": "jvasp-41050",
"created_at": "2022-09-04T14:38:29.012661Z",
"updated_at": "2022-09-04T14:38:29.012682Z",
"structure_string": "Na6 Np2 H4 O12\n1.0\n0.000000 -2.955824 -5.225510\n0.000000 -2.955824 5.225510\n-10.052457 2.955824 0.000000\nNa Np H O\n6 2 4 12\ndirect\n0.131410 0.868589 0.000000 Na\n0.904956 0.318315 0.176046 Na\n0.978908 0.892268 0.323953 Na\n0.381410 0.618587 0.500000 Na\n0.107731 0.021091 0.676045 Na\n0.681686 0.095044 0.823955 Na\n0.470762 0.529238 0.000000 Np\n0.720762 0.279236 0.500000 Np\n0.573206 0.482190 0.711085 H\n0.112120 0.521106 0.788915 H\n0.478895 0.887880 0.211086 H\n0.517810 0.426795 0.288916 H\n0.671813 0.733674 0.883806 O\n0.814933 0.615286 0.112660 O\n0.266326 0.328188 0.116194 O\n0.518674 0.892711 0.122569 O\n0.646108 0.520143 0.377431 O\n0.400134 0.961993 0.383806 O\n0.952275 0.252625 0.387340 O\n0.747375 0.047726 0.612660 O\n0.038007 0.599866 0.616195 O\n0.479858 0.353892 0.622569 O\n0.107290 0.481325 0.877431 O\n0.384715 0.185067 0.887340 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"Np",
"H",
"O"
],
"chemical_system": "H-Na-Np-O",
"density": 4.320471960749271,
"density_atomic": 0.07728616676429786,
"volume": 310.53422630201834,
"volume_molar": 7.792003423285203,
"formula_full": "Na6 Np2 H4 O12",
"formula_reduced": "Na3Np(HO3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.324870666666667,
"spacegroup": 43
},
{
"id": "jvasp-96934",
"created_at": "2022-09-04T14:36:02.521308Z",
"updated_at": "2022-09-04T14:36:02.521337Z",
"structure_string": "Na4 P4 H16 O20\n1.0\n7.345215 0.000000 0.000000\n0.000000 7.563727 0.000000\n0.000000 0.000000 7.823493\nNa P H O\n4 4 16 20\ndirect\n0.981331 0.502003 0.485345 Na\n0.481331 0.997998 0.985345 Na\n0.981331 0.002003 0.014655 Na\n0.481331 0.497998 0.514654 Na\n0.746531 0.375158 0.876696 P\n0.246531 0.124842 0.376696 P\n0.746531 0.875158 0.623304 P\n0.246531 0.624842 0.123304 P\n0.458710 0.448548 0.891001 H\n0.850122 0.210538 0.658174 H\n0.850122 0.710538 0.841826 H\n0.958710 0.051453 0.391001 H\n0.209840 0.694720 0.771179 H\n0.958710 0.551453 0.108998 H\n0.722577 0.720921 0.090445 H\n0.222577 0.779079 0.590445 H\n0.722577 0.220921 0.409555 H\n0.709841 0.305280 0.228821 H\n0.222577 0.279079 0.909555 H\n0.350122 0.289462 0.158174 H\n0.350122 0.789462 0.341826 H\n0.709841 0.805281 0.271179 H\n0.209840 0.194720 0.728821 H\n0.458710 0.948548 0.608998 H\n0.733884 0.721083 0.501668 O\n0.827623 0.544552 0.954884 O\n0.864641 0.333501 0.712948 O\n0.553591 0.425368 0.797408 O\n0.364641 0.166499 0.212948 O\n0.327622 0.955449 0.454884 O\n0.211455 0.663696 0.648112 O\n0.553591 0.925368 0.702592 O\n0.233884 0.278917 0.498331 O\n0.827623 0.044552 0.545115 O\n0.053591 0.074633 0.297408 O\n0.711455 0.336304 0.351888 O\n0.733884 0.221083 -0.001668 O\n0.864641 0.833501 0.787052 O\n0.211455 0.163696 0.851887 O\n0.053591 0.574633 0.202592 O\n0.233884 0.778917 0.001668 O\n0.364641 0.666500 0.287052 O\n0.711455 0.836304 0.148112 O\n0.327622 0.455449 0.045116 O\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Na",
"P",
"H",
"O"
],
"chemical_system": "H-Na-O-P",
"density": 2.1087391381869156,
"density_atomic": 0.1012305555851219,
"volume": 434.65137325065507,
"volume_molar": 5.948935798278963,
"formula_full": "Na4 P4 H16 O20",
"formula_reduced": "NaPH4O5",
"formula_anonymous": "ABC4D5",
"energy_above_hull": 2.5601783636363638,
"spacegroup": 33
},
{
"id": "jvasp-96878",
"created_at": "2022-09-04T14:36:08.300321Z",
"updated_at": "2022-09-04T14:36:08.300342Z",
"structure_string": "Na10 P6 H4 O22\n1.0\n10.698082 0.064896 -1.643838\n-0.683893 6.864147 -5.250240\n0.040453 -0.137504 6.860797\nNa P H O\n10 6 4 22\ndirect\n0.244953 0.000879 0.085108 Na\n0.755047 0.999123 0.914894 Na\n0.250493 0.583967 0.539854 Na\n0.749506 0.416035 0.460147 Na\n0.246700 0.562385 0.013936 Na\n0.753299 0.437616 0.986066 Na\n0.495715 0.779242 0.451731 Na\n0.504285 0.220759 0.548271 Na\n0.006525 0.815546 0.521070 Na\n-0.006525 0.184455 0.478932 Na\n0.027399 0.317424 0.116520 P\n0.466369 0.311426 0.110901 P\n0.972601 0.682577 0.883481 P\n0.280563 0.048348 0.623468 P\n0.719437 0.951654 0.376533 P\n0.533631 0.688575 0.889101 P\n0.500000 0.000000 0.000000 H\n0.000000 0.500000 0.000000 H\n0.975203 0.975413 0.943188 H\n0.024797 0.024589 0.056814 H\n0.807051 0.792256 0.320159 O\n0.192949 0.207746 0.679843 O\n0.871130 0.714175 0.735115 O\n0.128870 0.285827 0.264886 O\n0.065658 0.518415 0.174776 O\n0.894830 0.318619 0.175958 O\n0.934342 0.481587 0.825225 O\n0.600675 0.387069 0.156447 O\n0.105170 0.681382 0.824044 O\n0.399325 0.612933 0.843555 O\n0.581669 0.825034 0.193831 O\n0.543308 0.844151 0.841888 O\n0.378993 0.472988 0.243509 O\n0.621007 0.527013 0.756493 O\n0.758163 0.082602 0.315081 O\n0.241837 0.917400 0.684920 O\n0.680418 0.065309 0.635780 O\n0.319582 0.934693 0.364221 O\n0.418331 0.174968 0.806170 O\n0.994323 0.841744 0.178550 O\n0.456692 0.155851 0.158114 O\n0.005677 0.158257 0.821452 O\n",
"nsites": 42,
"nelements": 4,
"elements": [
"Na",
"P",
"H",
"O"
],
"chemical_system": "H-Na-O-P",
"density": 2.5802056979257775,
"density_atomic": 0.08456154684159271,
"volume": 496.67965604600016,
"volume_molar": 7.121606669850948,
"formula_full": "Na10 P6 H4 O22",
"formula_reduced": "Na5P3H2O11",
"formula_anonymous": "A2B3C5D11",
"energy_above_hull": 2.14017619047619,
"spacegroup": 2
}
]
}