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=-volume&page=276",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=274",
"results": [
{
"id": "jvasp-110704",
"created_at": "2022-09-04T14:38:37.418580Z",
"updated_at": "2022-09-04T14:38:37.418608Z",
"structure_string": "Rb2 Ag1 Bi1 I6\n1.0\n7.381539 -0.000000 4.261733\n2.460513 6.959381 4.261733\n-0.000000 -0.000000 8.523467\nRb Ag Bi I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.745277 0.254723 0.254722 I\n0.254723 0.254723 0.745277 I\n0.254723 0.745277 0.745277 I\n0.254723 0.745277 0.254723 I\n0.745277 0.254723 0.745277 I\n0.745277 0.745277 0.254722 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Bi",
"I"
],
"chemical_system": "Ag-Bi-I-Rb",
"density": 4.737520348346032,
"density_atomic": 0.02283842677033332,
"volume": 437.8585311747396,
"volume_molar": 26.3684570770113,
"formula_full": "Rb2 Ag1 Bi1 I6",
"formula_reduced": "Rb2AgBiI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-21480",
"created_at": "2022-09-04T14:38:34.632370Z",
"updated_at": "2022-09-04T14:38:34.632386Z",
"structure_string": "Y12 Pt4\n1.0\n6.490606 0.000000 0.000000\n0.000000 7.053932 0.000000\n0.000000 0.000000 9.561614\nY Pt\n12 4\ndirect\n0.131306 0.025240 0.250000 Y\n0.631307 0.474760 0.750000 Y\n0.368694 0.525240 0.250000 Y\n0.868694 0.974760 0.750000 Y\n0.678849 0.180173 0.060463 Y\n0.178849 0.319827 0.939537 Y\n0.821152 0.680173 0.439537 Y\n0.321152 0.819827 0.560463 Y\n0.321152 0.819827 0.939537 Y\n0.821152 0.680173 0.060463 Y\n0.178849 0.319827 0.560463 Y\n0.678849 0.180173 0.439537 Y\n0.949741 0.387730 0.250000 Pt\n0.449741 0.112270 0.750000 Pt\n0.550260 0.887730 0.250000 Pt\n0.050260 0.612269 0.750000 Pt\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Y",
"Pt"
],
"chemical_system": "Pt-Y",
"density": 7.006752095004108,
"density_atomic": 0.036548727392640014,
"volume": 437.771740397779,
"volume_molar": 16.477019008910023,
"formula_full": "Y12 Pt4",
"formula_reduced": "Y3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6450269375,
"spacegroup": 62
},
{
"id": "jvasp-109926",
"created_at": "2022-09-04T14:38:11.881911Z",
"updated_at": "2022-09-04T14:38:11.881921Z",
"structure_string": "Ba6 Ca2\n1.0\n8.512294 0.000000 0.000000\n-4.256147 7.371863 0.000000\n-0.000000 -0.000000 6.976221\nBa Ca\n6 2\ndirect\n0.168360 0.336719 0.250000 Ba\n0.663280 0.831640 0.250000 Ba\n0.168360 0.831640 0.250000 Ba\n0.831639 0.663281 0.750000 Ba\n0.336719 0.168360 0.750000 Ba\n0.831639 0.168360 0.750000 Ba\n0.333333 0.666666 0.750000 Ca\n0.666666 0.333333 0.250000 Ca\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Ca"
],
"chemical_system": "Ba-Ca",
"density": 3.429494512894846,
"density_atomic": 0.01827451611354943,
"volume": 437.7680891954503,
"volume_molar": 32.95376316714046,
"formula_full": "Ba6 Ca2",
"formula_reduced": "Ba3Ca",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-59848",
"created_at": "2022-09-04T14:38:33.432685Z",
"updated_at": "2022-09-04T14:38:33.432699Z",
"structure_string": "Y2 Cr6 Se4 Cl2 O16\n1.0\n6.496835 0.000000 0.000000\n0.000000 7.004044 0.000000\n0.000000 0.000000 9.619688\nY Cr Se Cl O\n2 6 4 2 16\ndirect\n0.000000 0.731547 0.500000 Y\n0.500000 0.268452 0.000000 Y\n0.250000 0.000000 0.250000 Cr\n0.250000 0.000000 0.750000 Cr\n0.749999 0.000000 0.250000 Cr\n0.500000 0.789738 0.000000 Cr\n0.000000 0.210261 0.500000 Cr\n0.749999 0.000000 0.750000 Cr\n0.000000 0.415986 0.816883 Se\n0.500000 0.584014 0.683117 Se\n0.500000 0.584014 0.316883 Se\n0.000000 0.415986 0.183117 Se\n0.000000 0.852002 0.000000 Cl\n0.500000 0.147998 0.500000 Cl\n0.708557 0.738312 0.659250 O\n0.291442 0.738312 0.659250 O\n0.208558 0.261687 0.159250 O\n0.500000 -0.001450 0.863874 O\n0.000000 0.001450 0.636126 O\n0.791442 0.261687 0.159250 O\n0.708557 0.738312 0.340750 O\n0.000000 0.001450 0.363874 O\n0.791442 0.261687 0.840751 O\n0.208558 0.261687 0.840751 O\n0.291442 0.738312 0.340750 O\n0.500000 0.567459 0.865318 O\n0.000000 0.432540 0.365318 O\n0.500000 0.567459 0.134682 O\n0.500000 -0.001450 0.136126 O\n0.000000 0.432540 0.634683 O\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Y",
"Cr",
"Se",
"Cl",
"O"
],
"chemical_system": "Cl-Cr-O-Se-Y",
"density": 4.296205934333293,
"density_atomic": 0.06853454996463215,
"volume": 437.7354198062402,
"volume_molar": 8.787014379036235,
"formula_full": "Y2 Cr6 Se4 Cl2 O16",
"formula_reduced": "YCr3Se2ClO8",
"formula_anonymous": "ABC2D3E8",
"energy_above_hull": 3.156442430055556,
"spacegroup": 59
},
{
"id": "jvasp-12085",
"created_at": "2022-09-04T14:36:45.239610Z",
"updated_at": "2022-09-04T14:36:45.239629Z",
"structure_string": "Th4 I8\n1.0\n3.962336 0.000000 0.000000\n-1.981168 3.431484 0.000000\n-0.000000 -0.000000 32.193689\nTh I\n4 8\ndirect\n0.666667 0.333333 0.750000 Th\n0.333333 0.666666 0.250000 Th\n0.000000 0.000000 0.500000 Th\n0.000000 0.000000 0.000000 Th\n0.333333 0.666666 0.428683 I\n0.666667 0.333333 0.928683 I\n0.666667 0.333333 0.571317 I\n0.333333 0.666666 0.071317 I\n0.000000 0.000000 0.179421 I\n0.000000 0.000000 0.679421 I\n0.000000 0.000000 0.820579 I\n0.000000 0.000000 0.320579 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Th",
"I"
],
"chemical_system": "I-Th",
"density": 7.372327020643695,
"density_atomic": 0.027414303924328327,
"volume": 437.72769256237865,
"volume_molar": 21.967148159672078,
"formula_full": "Th4 I8",
"formula_reduced": "ThI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4408893833333335,
"spacegroup": 194
},
{
"id": "jvasp-29532",
"created_at": "2022-09-04T14:37:52.301030Z",
"updated_at": "2022-09-04T14:37:52.301049Z",
"structure_string": "Cd4 I8\n1.0\n4.284840 0.000000 -0.000000\n-2.142421 3.710781 0.000000\n-0.000000 0.000000 27.518151\nCd I\n4 8\ndirect\n0.333333 0.666667 0.062500 Cd\n0.000000 0.000000 0.812452 Cd\n0.666667 0.333333 0.312548 Cd\n0.333333 0.666667 0.562500 Cd\n0.333333 0.666667 0.375557 I\n0.000000 0.000000 0.499464 I\n0.333333 0.666667 0.749442 I\n0.666667 0.333333 0.625536 I\n0.666667 0.333333 0.875510 I\n0.000000 0.000000 -0.000530 I\n0.000000 0.000000 0.249490 I\n0.666667 0.333333 0.125530 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.559450819246317,
"density_atomic": 0.027425974178278117,
"volume": 437.54143141811255,
"volume_molar": 21.957800736098,
"formula_full": "Cd4 I8",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.0000000000030003e-05,
"spacegroup": 164
},
{
"id": "jvasp-29604",
"created_at": "2022-09-04T14:38:29.220115Z",
"updated_at": "2022-09-04T14:38:29.220141Z",
"structure_string": "Cd4 I8\n1.0\n4.285445 -0.000000 -0.000000\n-2.142723 3.711305 0.000000\n-0.000000 0.000000 27.508795\nCd I\n4 8\ndirect\n0.333333 0.666666 0.750033 Cd\n0.333333 0.666666 -0.000061 Cd\n0.666668 0.333333 0.250033 Cd\n0.666668 0.333333 0.499938 Cd\n0.333333 0.666666 0.187006 I\n0.000000 0.000000 0.813082 I\n0.000000 0.000000 0.063014 I\n0.666668 0.333333 0.936927 I\n0.666668 0.333333 0.687006 I\n0.000000 0.000000 0.313083 I\n0.333333 0.666666 0.436926 I\n0.000000 0.000000 0.563014 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.559771419139654,
"density_atomic": 0.027427555766942557,
"volume": 437.5162009318806,
"volume_molar": 21.9565345566019,
"formula_full": "Cd4 I8",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.6666666666674832e-05,
"spacegroup": 186
},
{
"id": "jvasp-119043",
"created_at": "2022-09-04T14:38:48.437312Z",
"updated_at": "2022-09-04T14:38:48.437322Z",
"structure_string": "Ce6 Ir18\n1.0\n5.340406 -0.000000 0.000000\n-2.670204 4.624927 0.000000\n0.000000 0.000000 17.708889\nCe Ir\n6 18\ndirect\n0.333334 0.666667 0.957779 Ce\n0.666667 0.333334 0.042221 Ce\n0.666667 0.333334 0.457779 Ce\n0.333334 0.666667 0.542221 Ce\n0.333334 0.666667 0.750000 Ce\n0.666667 0.333334 0.250000 Ce\n0.000000 0.000000 0.750000 Ir\n0.000000 0.000000 0.250000 Ir\n0.666667 0.333334 0.750000 Ir\n0.333334 0.666667 0.250000 Ir\n0.664610 0.832305 0.126258 Ir\n0.167696 0.335392 0.126258 Ir\n0.167696 0.832305 0.126258 Ir\n0.335392 0.167695 0.873742 Ir\n0.335392 0.167695 0.626258 Ir\n0.832305 0.167695 0.873742 Ir\n0.000000 0.000000 0.500000 Ir\n0.832306 0.664609 0.626258 Ir\n0.832305 0.167695 0.626258 Ir\n0.664610 0.832305 0.373742 Ir\n0.167696 0.335392 0.373742 Ir\n0.167696 0.832305 0.373742 Ir\n0.832306 0.664609 0.873742 Ir\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Ce",
"Ir"
],
"chemical_system": "Ce-Ir",
"density": 16.327055794321936,
"density_atomic": 0.05487073385005666,
"volume": 437.39163513985363,
"volume_molar": 10.975141641911504,
"formula_full": "Ce6 Ir18",
"formula_reduced": "CeIr3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.8349947,
"spacegroup": 194
},
{
"id": "jvasp-26948",
"created_at": "2022-09-04T14:38:36.729423Z",
"updated_at": "2022-09-04T14:38:36.729443Z",
"structure_string": "Rb7 Au5 O2\n1.0\n5.448295 0.000060 -1.623043\n-1.303863 8.149771 -4.376550\n-0.020873 -0.049407 9.884707\nRb Au O\n7 5 2\ndirect\n0.000000 0.500000 -0.000000 Rb\n0.499996 0.788627 -0.000002 Rb\n0.500004 0.211373 0.000002 Rb\n0.168092 0.391540 0.336189 Rb\n0.831908 0.608460 0.663811 Rb\n0.831913 0.055355 0.663816 Rb\n0.168087 0.944645 0.336184 Rb\n0.000000 0.000000 0.000000 Au\n0.350959 0.350941 0.701888 Au\n0.649041 0.649059 0.298112 Au\n0.688045 0.188050 0.376106 Au\n0.311955 0.811950 0.623895 Au\n0.000011 0.216538 0.000005 O\n-0.000010 0.783462 -0.000005 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"Au",
"O"
],
"chemical_system": "Au-O-Rb",
"density": 6.132318777799396,
"density_atomic": 0.0320112449500223,
"volume": 437.34631445473497,
"volume_molar": 18.812579046525972,
"formula_full": "Rb7 Au5 O2",
"formula_reduced": "Rb7Au5O2",
"formula_anonymous": "A2B5C7",
"energy_above_hull": 0.0996737650000002,
"spacegroup": 71
},
{
"id": "jvasp-37892",
"created_at": "2022-09-04T14:38:02.976477Z",
"updated_at": "2022-09-04T14:38:02.976504Z",
"structure_string": "Ba2 Sr6\n1.0\n4.250669 -7.362374 -0.000000\n4.250669 7.362374 -0.000000\n-0.000000 -0.000000 6.986456\nBa Sr\n2 6\ndirect\n0.333333 0.666667 0.250000 Ba\n0.666667 0.333333 0.750000 Ba\n0.667075 0.833538 0.750000 Sr\n0.166462 0.332925 0.750000 Sr\n0.166462 0.833538 0.750000 Sr\n0.332925 0.166462 0.250000 Sr\n0.833538 0.667075 0.250000 Sr\n0.833538 0.166462 0.250000 Sr\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Sr"
],
"chemical_system": "Ba-Sr",
"density": 3.0393448775273844,
"density_atomic": 0.018294809853373666,
"volume": 437.2824896305088,
"volume_molar": 32.91720880547706,
"formula_full": "Ba2 Sr6",
"formula_reduced": "BaSr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.039040909090909,
"spacegroup": 194
},
{
"id": "jvasp-29993",
"created_at": "2022-09-04T14:38:10.989248Z",
"updated_at": "2022-09-04T14:38:10.989283Z",
"structure_string": "Cd4 I8\n1.0\n4.285697 0.000000 -0.000000\n-2.142848 3.711523 0.000000\n-0.000000 0.000000 27.490042\nCd I\n4 8\ndirect\n0.000000 -0.000000 0.562491 Cd\n0.666667 0.333333 0.312448 Cd\n0.666667 0.333333 0.812473 Cd\n0.666667 0.333333 0.062532 Cd\n0.333333 0.666667 0.375556 I\n0.333333 0.666667 0.125613 I\n0.333333 0.666667 0.875556 I\n-0.000000 0.000000 -0.000530 I\n0.666667 0.333333 0.499446 I\n0.000000 -0.000000 0.749419 I\n0.333333 0.666667 0.625591 I\n0.000000 -0.000000 0.249405 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.562910251125188,
"density_atomic": 0.027443040304495653,
"volume": 437.26933557118264,
"volume_molar": 21.944145740344474,
"formula_full": "Cd4 I8",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.00016,
"spacegroup": 156
},
{
"id": "jvasp-51066",
"created_at": "2022-09-04T14:38:17.059897Z",
"updated_at": "2022-09-04T14:38:17.059924Z",
"structure_string": "K4 Sr4 V4 O16\n1.0\n5.860188 0.000000 0.000000\n0.000000 7.473053 0.000000\n0.000000 0.000000 9.983800\nK Sr V O\n4 4 4 16\ndirect\n0.484529 0.093432 0.577923 K\n0.515471 0.593432 0.922077 K\n0.015471 0.906567 0.077923 K\n0.984530 0.406567 0.422077 K\n0.978395 0.248945 0.801871 Sr\n0.478395 0.251055 0.198130 Sr\n0.521606 0.751055 0.301870 Sr\n0.021605 0.748944 0.698130 Sr\n0.515073 0.024581 0.915793 V\n0.984927 0.975419 0.415793 V\n0.015073 0.475419 0.084207 V\n0.484927 0.524581 0.584207 V\n0.430795 0.749121 0.563235 O\n0.238874 0.016751 0.330871 O\n0.492779 0.427798 0.426005 O\n0.007222 0.572201 0.926005 O\n0.756234 0.058514 0.325787 O\n0.992779 0.072202 0.573995 O\n0.261126 0.983249 0.830872 O\n0.243766 0.558513 0.174213 O\n0.569205 0.249122 0.936765 O\n0.743766 0.941486 0.825787 O\n0.069205 0.250878 0.063235 O\n0.256234 0.441486 0.674213 O\n0.738875 0.483249 0.669129 O\n0.507222 0.927798 0.073995 O\n0.761126 0.516751 0.169129 O\n0.930796 0.750878 0.436765 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"K",
"Sr",
"V",
"O"
],
"chemical_system": "K-O-Sr-V",
"density": 3.6711633055508965,
"density_atomic": 0.06404018056401406,
"volume": 437.22550051231383,
"volume_molar": 9.403691099809308,
"formula_full": "K4 Sr4 V4 O16",
"formula_reduced": "KSrVO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.629713215714286,
"spacegroup": 19
}
]
}