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=energy_above_hull&page=4357",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4355",
"results": [
{
"id": "jvasp-19684",
"created_at": "2022-09-04T14:37:49.154583Z",
"updated_at": "2022-09-04T14:37:49.154603Z",
"structure_string": "Nb6 Ge2\n1.0\n5.184173 0.000000 -0.000000\n-0.000000 5.184173 -0.000000\n0.000000 -0.000000 5.184173\nNb Ge\n6 2\ndirect\n0.250000 0.000000 0.500000 Nb\n0.750000 0.000000 0.500000 Nb\n0.000000 0.500000 0.250000 Nb\n0.000000 0.500000 0.750000 Nb\n0.500000 0.750000 0.000000 Nb\n0.500000 0.250000 0.000000 Nb\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nb",
"Ge"
],
"chemical_system": "Ge-Nb",
"density": 8.375136441942736,
"density_atomic": 0.05741845856637106,
"volume": 139.328017500725,
"volume_molar": 10.488161665013866,
"formula_full": "Nb6 Ge2",
"formula_reduced": "Nb3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 4.253516037500001,
"spacegroup": 223
},
{
"id": "jvasp-103968",
"created_at": "2022-09-04T14:36:32.215678Z",
"updated_at": "2022-09-04T14:36:32.215689Z",
"structure_string": "Cd1 H8 C6 O4\n1.0\n3.890062 -0.125520 -0.338017\n-0.786156 4.170664 -0.237144\n-0.012827 0.096139 10.065311\nCd H C O\n1 8 6 4\ndirect\n0.955196 0.634045 0.185836 Cd\n0.847911 0.410677 0.525398 H\n0.428693 0.500329 0.514467 H\n0.657093 0.950421 0.661917 H\n0.710756 0.468095 0.803585 H\n0.511978 0.950201 0.909865 H\n0.076346 0.923686 0.842233 H\n0.211078 0.945031 0.615382 H\n0.272622 0.475029 0.746664 H\n0.251106 0.264796 0.006039 C\n0.321444 0.096011 0.879471 C\n0.452165 0.312615 0.768982 C\n0.456394 0.109099 0.386218 C\n0.566181 0.299413 0.520434 C\n0.470013 0.107235 0.641696 C\n0.001284 0.129102 0.071315 O\n0.204102 0.857916 0.382102 O\n0.601473 0.204228 0.283365 O\n0.427609 0.550011 0.044702 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.623024673385068,
"density_atomic": 0.11699249927074583,
"volume": 162.40357389092023,
"volume_molar": 5.147458852095698,
"formula_full": "Cd1 H8 C6 O4",
"formula_reduced": "CdH8(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.253597039473684,
"spacegroup": 1
},
{
"id": "jvasp-101954",
"created_at": "2022-09-04T14:36:43.287130Z",
"updated_at": "2022-09-04T14:36:43.287147Z",
"structure_string": "Cd1 H8 C6 O4\n1.0\n3.926606 0.068910 -0.058839\n1.478355 4.380165 0.340175\n-0.191782 -0.103008 9.365599\nCd H C O\n1 8 6 4\ndirect\n0.605360 0.719559 0.796053 Cd\n0.851979 0.682862 0.485703 H\n0.278581 0.588953 0.416764 H\n0.743579 0.477479 0.274490 H\n0.372188 0.283199 0.193898 H\n0.932856 0.850142 0.175350 H\n0.359358 0.756457 0.106342 H\n0.839045 0.156082 0.398143 H\n0.467708 0.961826 0.317569 H\n0.960596 0.134049 0.994921 C\n0.129781 0.951982 0.134591 C\n0.251481 0.128518 0.248448 C\n0.250452 0.305150 0.597181 C\n0.081500 0.487250 0.457489 C\n0.959784 0.310758 0.343611 C\n-0.005496 0.990158 0.880008 O\n0.419508 0.018489 0.594413 O\n0.216330 0.449020 0.712108 O\n0.791557 0.420713 -0.002305 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.6587866559825684,
"density_atomic": 0.11858756002843174,
"volume": 160.2191662889825,
"volume_molar": 5.078223009695261,
"formula_full": "Cd1 H8 C6 O4",
"formula_reduced": "CdH8(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.253605460526315,
"spacegroup": 2
},
{
"id": "jvasp-38407",
"created_at": "2022-09-04T14:38:33.059359Z",
"updated_at": "2022-09-04T14:38:33.059390Z",
"structure_string": "Pr2 Co8 B8\n1.0\n3.789698 0.000118 0.000056\n-0.000251 7.109231 0.001846\n-0.000088 -0.001779 7.109325\nPr Co B\n2 8 8\ndirect\n0.249998 0.750000 0.250001 Pr\n0.750002 0.250000 0.750000 Pr\n0.143582 0.363853 0.393521 Co\n0.643578 0.393523 0.136150 Co\n0.643578 0.106478 0.363851 Co\n0.143584 0.136147 0.106479 Co\n0.856417 0.863853 0.893522 Co\n0.356422 0.606477 0.863850 Co\n0.356422 0.893522 0.636150 Co\n0.856419 0.636147 0.606479 Co\n0.353773 0.545291 0.588004 B\n0.146224 0.412000 0.045293 B\n0.146224 0.088000 0.454707 B\n0.646227 0.454709 0.411997 B\n0.646227 0.045291 0.088004 B\n0.853777 0.588000 0.954707 B\n0.853776 0.912000 0.545294 B\n0.353773 0.954709 0.911996 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Pr",
"Co",
"B"
],
"chemical_system": "B-Co-Pr",
"density": 7.280366424893424,
"density_atomic": 0.09397598350863776,
"volume": 191.5382987010244,
"volume_molar": 6.408169976158301,
"formula_full": "Pr2 Co8 B8",
"formula_reduced": "Pr(CoB)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 4.253904864814814,
"spacegroup": 86
},
{
"id": "jvasp-112178",
"created_at": "2022-09-04T14:38:44.569191Z",
"updated_at": "2022-09-04T14:38:44.569211Z",
"structure_string": "Cd1 H8 C6 O4\n1.0\n3.673809 0.030261 0.030001\n1.745384 4.674632 1.425099\n-0.014356 0.069588 9.441327\nCd H C O\n1 8 6 4\ndirect\n0.889674 0.511382 0.199720 Cd\n0.657785 0.976213 0.617152 H\n0.209611 0.000451 0.544405 H\n0.893897 0.454940 0.562477 H\n0.992489 0.549763 0.804310 H\n0.129328 0.040639 0.782198 H\n0.691140 0.050551 0.856221 H\n0.411674 0.489406 0.592815 H\n0.521227 0.564321 0.844876 H\n0.138940 0.031189 0.006489 C\n0.920535 0.142288 0.852433 C\n0.764094 0.468295 0.784826 C\n0.645954 -0.009326 0.393871 C\n0.524275 0.886556 0.547877 C\n0.645828 0.561007 0.617413 C\n0.287617 0.752100 0.060445 O\n0.873254 0.819790 0.333938 O\n0.522834 0.269332 0.338151 O\n0.192781 0.199309 0.069481 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.641222754231441,
"density_atomic": 0.11780417252023936,
"volume": 161.2846098191955,
"volume_molar": 5.111992751330913,
"formula_full": "Cd1 H8 C6 O4",
"formula_reduced": "CdH8(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.253957039473684,
"spacegroup": 1
},
{
"id": "jvasp-101955",
"created_at": "2022-09-04T14:36:48.896460Z",
"updated_at": "2022-09-04T14:36:48.896481Z",
"structure_string": "Cd1 H8 C6 O4\n1.0\n3.591659 -0.032549 0.377704\n0.023593 4.216852 0.204187\n-0.125085 0.030368 10.377131\nCd H C O\n1 8 6 4\ndirect\n0.639252 0.717956 0.204048 Cd\n0.357538 0.513872 0.505744 H\n0.885219 0.550366 0.549809 H\n0.357847 0.970363 0.613406 H\n0.398099 0.463909 0.748716 H\n0.505331 0.983774 0.880280 H\n0.059459 0.842633 0.868961 H\n0.872869 0.982216 0.648662 H\n0.915716 0.436026 0.786194 H\n0.073517 0.165439 0.011036 C\n0.216963 0.062604 0.877449 C\n0.165556 0.294103 0.762676 C\n0.000006 0.263764 0.394684 C\n0.101084 0.373915 0.523688 C\n0.124228 0.130577 0.636254 C\n0.158931 0.978496 0.107847 O\n0.783855 0.031998 0.388802 O\n0.116012 0.446410 0.293802 O\n0.850140 0.393413 0.023458 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.707219490221706,
"density_atomic": 0.12074776781522699,
"volume": 157.3528053046459,
"volume_molar": 4.987372329081328,
"formula_full": "Cd1 H8 C6 O4",
"formula_reduced": "CdH8(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.254431776315789,
"spacegroup": 1
},
{
"id": "jvasp-100627",
"created_at": "2022-09-04T14:37:02.810049Z",
"updated_at": "2022-09-04T14:37:02.810079Z",
"structure_string": "Sm1 Cr2 Si2 C1\n1.0\n3.984869 0.000000 0.000000\n-0.000000 3.984869 0.000000\n-0.000000 -0.000000 5.339533\nSm Cr Si C\n1 2 2 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.500000 0.500000 0.269803 Si\n0.500000 0.500000 0.730197 Si\n0.000000 0.000000 0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Sm",
"Cr",
"Si",
"C"
],
"chemical_system": "C-Cr-Si-Sm",
"density": 6.316741329347625,
"density_atomic": 0.07076522271237876,
"volume": 84.78741068033743,
"volume_molar": 8.510028696548657,
"formula_full": "Sm1 Cr2 Si2 C1",
"formula_reduced": "SmCr2Si2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 4.254500145833333,
"spacegroup": 123
},
{
"id": "jvasp-62981",
"created_at": "2022-09-04T14:35:40.748554Z",
"updated_at": "2022-09-04T14:35:40.748567Z",
"structure_string": "Th1 B2 Pt2 C1\n1.0\n-1.927033 1.927033 5.456641\n1.927033 -1.927033 5.456641\n1.927033 1.927033 -5.456641\nTh B Pt C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 Th\n0.635960 0.635960 0.000000 B\n0.364039 0.364039 0.000000 B\n0.250000 0.749999 0.499999 Pt\n0.749999 0.250000 0.499999 Pt\n0.500000 0.500000 0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Th",
"B",
"Pt",
"C"
],
"chemical_system": "B-C-Pt-Th",
"density": 13.436386882675997,
"density_atomic": 0.07402656086498019,
"volume": 81.05198904138778,
"volume_molar": 8.135108114753578,
"formula_full": "Th1 B2 Pt2 C1",
"formula_reduced": "ThB2Pt2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 4.2551455944444445,
"spacegroup": 139
},
{
"id": "jvasp-103716",
"created_at": "2022-09-04T14:37:03.790848Z",
"updated_at": "2022-09-04T14:37:03.790877Z",
"structure_string": "Hf4 Ag1 Pd1\n1.0\n3.229815 -0.000000 0.000000\n0.000000 3.229815 0.000000\n-0.000000 -0.000000 11.461959\nHf Ag Pd\n4 1 1\ndirect\n0.500001 0.500001 0.170309 Hf\n0.000000 0.000000 0.653806 Hf\n0.000000 0.000000 0.346194 Hf\n0.500001 0.500001 0.829691 Hf\n0.000000 0.000000 0.000000 Ag\n0.500001 0.500001 0.500000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Ag",
"Pd"
],
"chemical_system": "Ag-Hf-Pd",
"density": 12.891369846013516,
"density_atomic": 0.05018074508223649,
"volume": 119.56777425618465,
"volume_molar": 12.000899448844136,
"formula_full": "Hf4 Ag1 Pd1",
"formula_reduced": "Hf4AgPd",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.255210826666667,
"spacegroup": 123
},
{
"id": "jvasp-62838",
"created_at": "2022-09-04T14:35:48.014948Z",
"updated_at": "2022-09-04T14:35:48.014957Z",
"structure_string": "Dy4 V4 B16\n1.0\n3.467071 0.000000 0.000000\n0.000000 5.998979 0.000000\n0.000000 0.000000 11.609702\nDy V B\n4 4 16\ndirect\n0.000000 0.123748 0.848555 Dy\n0.000000 0.876252 0.151445 Dy\n0.000000 0.376252 0.348555 Dy\n0.000000 0.623748 0.651445 Dy\n0.000000 0.126718 0.582717 V\n0.000000 0.873282 0.417283 V\n0.000000 0.373282 0.082717 V\n0.000000 0.626718 0.917283 V\n0.500000 0.523467 0.192159 B\n0.500000 0.476534 0.807841 B\n0.500000 0.885307 0.547377 B\n0.500000 0.114694 0.452623 B\n0.500000 0.614694 0.047377 B\n0.500000 0.385307 0.952623 B\n0.500000 0.864197 0.967559 B\n0.500000 0.785897 0.814312 B\n0.500000 0.635804 0.467559 B\n0.500000 0.364197 0.532440 B\n0.500000 0.023467 0.307841 B\n0.500000 0.214103 0.185688 B\n0.500000 0.714103 0.314312 B\n0.500000 0.285897 0.685688 B\n0.500000 0.135803 0.032440 B\n0.500000 0.976534 0.692159 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Dy",
"V",
"B"
],
"chemical_system": "B-Dy-V",
"density": 7.060724654877403,
"density_atomic": 0.09939169393043638,
"volume": 241.4688697910456,
"volume_molar": 6.058998012665785,
"formula_full": "Dy4 V4 B16",
"formula_reduced": "DyVB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.256078505555557,
"spacegroup": 55
},
{
"id": "jvasp-106279",
"created_at": "2022-09-04T14:38:38.936859Z",
"updated_at": "2022-09-04T14:38:38.936870Z",
"structure_string": "Ti6 Nb2\n1.0\n5.800661 -0.000000 0.000000\n-2.900330 5.023520 0.000000\n-0.000000 -0.000000 4.788046\nTi Nb\n6 2\ndirect\n0.165896 0.331792 0.250000 Ti\n0.668208 0.834104 0.250000 Ti\n0.165896 0.834104 0.250000 Ti\n0.834104 0.668208 0.750001 Ti\n0.331792 0.165896 0.750001 Ti\n0.834104 0.165896 0.750001 Ti\n0.333333 0.666667 0.750001 Nb\n0.666667 0.333333 0.250000 Nb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"Nb"
],
"chemical_system": "Nb-Ti",
"density": 5.629630035117101,
"density_atomic": 0.05733846361989191,
"volume": 139.52239901357652,
"volume_molar": 10.502794075408037,
"formula_full": "Ti6 Nb2",
"formula_reduced": "Ti3Nb",
"formula_anonymous": "AB3",
"energy_above_hull": 4.2568636,
"spacegroup": 194
},
{
"id": "jvasp-86431",
"created_at": "2022-09-04T14:36:13.050068Z",
"updated_at": "2022-09-04T14:36:13.050097Z",
"structure_string": "Sm2 Cr2 Fe15\n1.0\n6.261498 0.014082 0.817901\n0.719822 6.220001 0.817901\n0.015771 0.014082 6.314671\nSm Cr Fe\n2 2 15\ndirect\n0.344410 0.344410 0.344410 Sm\n0.655590 0.655589 0.655589 Sm\n0.088892 0.088892 0.088892 Cr\n0.911108 0.911108 0.911108 Cr\n0.336675 0.845768 0.336675 Fe\n-0.000000 -0.000000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.294113 0.705887 -0.000000 Fe\n-0.000000 0.294113 0.705887 Fe\n0.705887 0.294113 -0.000000 Fe\n-0.000000 0.705887 0.294113 Fe\n0.294113 -0.000000 0.705887 Fe\n0.663325 0.154231 0.663324 Fe\n0.663324 0.663324 0.154232 Fe\n0.154232 0.663324 0.663324 Fe\n0.845768 0.336675 0.336675 Fe\n0.336675 0.336675 0.845768 Fe\n0.705887 -0.000000 0.294113 Fe\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Sm",
"Cr",
"Fe"
],
"chemical_system": "Cr-Fe-Sm",
"density": 8.395641750947547,
"density_atomic": 0.07732170710001002,
"volume": 245.7265975184029,
"volume_molar": 7.788421888061522,
"formula_full": "Sm2 Cr2 Fe15",
"formula_reduced": "Sm2Cr2Fe15",
"formula_anonymous": "A2B2C15",
"energy_above_hull": 4.2570460552631575,
"spacegroup": 166
}
]
}