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=formula_anonymous&page=992",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=990",
"results": [
{
"id": "jvasp-92295",
"created_at": "2022-09-04T14:35:49.017683Z",
"updated_at": "2022-09-04T14:35:49.017709Z",
"structure_string": "Y1 Si2 Pd2\n1.0\n4.169641 -0.000000 -0.000000\n-0.000000 4.169641 -0.000000\n-2.084820 -2.084820 4.982960\nY Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.617121 0.617121 0.234243 Si\n0.382879 0.382879 0.765757 Si\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Si",
"Pd"
],
"chemical_system": "Pd-Si-Y",
"density": 6.8603537776373695,
"density_atomic": 0.05771454477011521,
"volume": 86.63327450499129,
"volume_molar": 10.434355471375538,
"formula_full": "Y1 Si2 Pd2",
"formula_reduced": "Y(SiPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.48385481,
"spacegroup": 139
},
{
"id": "jvasp-88423",
"created_at": "2022-09-04T14:35:55.560782Z",
"updated_at": "2022-09-04T14:35:55.560810Z",
"structure_string": "Pb8 O4 F8\n1.0\n5.767839 -0.000000 0.000000\n-0.000000 8.229646 0.000000\n0.000000 0.000000 8.229646\nPb O F\n8 4 8\ndirect\n0.060532 0.250000 0.025250 Pb\n0.560532 0.025250 0.250000 Pb\n0.060532 0.250000 0.474750 Pb\n0.939468 0.750000 0.974750 Pb\n0.939468 0.750000 0.525251 Pb\n0.439468 0.525251 0.750000 Pb\n0.439468 0.974750 0.750000 Pb\n0.560532 0.474750 0.250000 Pb\n0.161934 0.750000 0.750000 O\n0.338066 0.250000 0.250000 O\n0.838066 0.250000 0.250000 O\n0.661934 0.750000 0.750000 O\n0.750000 0.039954 0.960046 F\n0.750000 0.039954 0.539955 F\n0.250000 0.539955 0.460046 F\n0.250000 0.539955 0.039954 F\n0.250000 0.960046 0.460046 F\n0.750000 0.460046 0.539955 F\n0.250000 0.960046 0.039954 F\n0.750000 0.460046 0.960046 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pb",
"O",
"F"
],
"chemical_system": "F-O-Pb",
"density": 7.964289164932275,
"density_atomic": 0.051198184107602636,
"volume": 390.6388546509038,
"volume_molar": 11.762410845164618,
"formula_full": "Pb8 O4 F8",
"formula_reduced": "Pb2OF2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.1555431409999997,
"spacegroup": 137
},
{
"id": "jvasp-69839",
"created_at": "2022-09-04T14:35:49.331126Z",
"updated_at": "2022-09-04T14:35:49.331154Z",
"structure_string": "Mg2 Be1 Cd2\n1.0\n-1.955265 1.955265 7.531786\n1.955265 -1.955265 7.531786\n1.955265 1.955265 -7.531786\nMg Be Cd\n2 1 2\ndirect\n0.592676 0.592676 0.000000 Mg\n0.407324 0.407324 0.000000 Mg\n0.000000 0.000000 0.000000 Be\n0.750001 0.250000 0.500001 Cd\n0.250000 0.750001 0.500001 Cd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Mg",
"density": 4.0720444945519345,
"density_atomic": 0.04341109978262754,
"volume": 115.1779159025343,
"volume_molar": 13.872352440170081,
"formula_full": "Mg2 Be1 Cd2",
"formula_reduced": "Mg2BeCd2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-92443",
"created_at": "2022-09-04T14:35:55.536667Z",
"updated_at": "2022-09-04T14:35:55.536691Z",
"structure_string": "Gd1 P2 Ru2\n1.0\n3.794349 0.000000 -1.465501\n-0.566024 3.751892 -1.465501\n-0.000039 -0.000046 5.644645\nGd P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Gd\n0.373512 0.373511 0.747024 P\n0.626489 0.626487 0.252975 P\n0.750000 0.249999 0.500000 Ru\n0.250001 0.749999 0.500000 Ru\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Gd",
"P",
"Ru"
],
"chemical_system": "Gd-P-Ru",
"density": 8.706783535038635,
"density_atomic": 0.062222651729653376,
"volume": 80.35658817184668,
"volume_molar": 9.678373699284236,
"formula_full": "Gd1 P2 Ru2",
"formula_reduced": "Gd(PRu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.3434491,
"spacegroup": 139
},
{
"id": "jvasp-92457",
"created_at": "2022-09-04T14:35:53.480080Z",
"updated_at": "2022-09-04T14:35:53.480100Z",
"structure_string": "Li2 Cu1 S2\n1.0\n3.447186 0.000756 -0.000093\n-1.723090 3.953312 0.443487\n-0.000190 0.758150 6.165843\nLi Cu S\n2 1 2\ndirect\n0.336214 0.665848 0.655439 Li\n0.671793 0.335472 0.333675 Li\n0.004010 0.000639 0.994480 Cu\n0.395610 0.783597 0.242179 S\n0.612440 0.217765 0.746907 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"Cu",
"S"
],
"chemical_system": "Cu-Li-S",
"density": 2.83631700490056,
"density_atomic": 0.06033110191368735,
"volume": 82.87599333347576,
"volume_molar": 9.981817949580254,
"formula_full": "Li2 Cu1 S2",
"formula_reduced": "Li2CuS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.8327660899999999,
"spacegroup": 12
},
{
"id": "jvasp-86811",
"created_at": "2022-09-04T14:35:55.637585Z",
"updated_at": "2022-09-04T14:35:55.637617Z",
"structure_string": "Yb4 Cd2 Sb4\n1.0\n4.476422 -0.000000 -1.186928\n0.000000 7.146663 0.000000\n-0.011350 0.000000 8.991926\nYb Cd Sb\n4 2 4\ndirect\n0.479539 0.718562 0.959080 Yb\n0.520460 0.218563 0.040921 Yb\n0.697429 0.533748 0.394858 Yb\n0.302571 0.033748 0.605142 Yb\n0.901971 0.396199 0.803944 Cd\n0.098029 0.896199 0.196057 Cd\n0.319931 0.514608 0.639863 Sb\n0.680068 0.014608 0.360137 Sb\n0.069373 0.494392 0.138747 Sb\n0.930626 0.994392 0.861253 Sb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Yb",
"Cd",
"Sb"
],
"chemical_system": "Cd-Sb-Yb",
"density": 8.107395088701784,
"density_atomic": 0.03477429444692983,
"volume": 287.5687388930729,
"volume_molar": 17.317794237897715,
"formula_full": "Yb4 Cd2 Sb4",
"formula_reduced": "Yb2CdSb2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 36
},
{
"id": "jvasp-92415",
"created_at": "2022-09-04T14:35:53.496501Z",
"updated_at": "2022-09-04T14:35:53.496519Z",
"structure_string": "La1 Al2 Zn2\n1.0\n4.017370 0.000000 -1.458557\n-0.529548 3.982315 -1.458557\n0.006049 0.006907 6.278553\nLa Al Zn\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.750000 0.250001 0.500000 Al\n0.250000 0.750001 0.500000 Al\n0.613267 0.613268 0.226533 Zn\n0.386733 0.386734 0.773467 Zn\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Al",
"Zn"
],
"chemical_system": "Al-La-Zn",
"density": 5.346713577010922,
"density_atomic": 0.04973741116802589,
"volume": 100.52795034121704,
"volume_molar": 12.10786934538198,
"formula_full": "La1 Al2 Zn2",
"formula_reduced": "La(AlZn)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3497242799999999,
"spacegroup": 139
},
{
"id": "jvasp-15599",
"created_at": "2022-09-04T14:35:55.663397Z",
"updated_at": "2022-09-04T14:35:55.663426Z",
"structure_string": "Nd1 Co2 B2\n1.0\n3.386713 -0.000000 -1.175287\n-0.407859 3.362064 -1.175287\n0.041531 0.046874 5.586905\nNd Co B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.249999 0.749998 0.499999 Co\n0.749999 0.249999 0.499999 Co\n0.662197 0.662197 0.324395 B\n0.337801 0.337801 0.675603 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Co",
"B"
],
"chemical_system": "B-Co-Nd",
"density": 7.3630754628125406,
"density_atomic": 0.07814016129693178,
"volume": 63.987582275394246,
"volume_molar": 7.706844547090105,
"formula_full": "Nd1 Co2 B2",
"formula_reduced": "Nd(CoB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.5506856933333326,
"spacegroup": 139
},
{
"id": "jvasp-63849",
"created_at": "2022-09-04T14:35:55.806098Z",
"updated_at": "2022-09-04T14:35:55.806124Z",
"structure_string": "Ce1 Si2 Au2\n1.0\n-2.178862 2.178862 5.083895\n2.178862 -2.178862 5.083895\n2.178862 2.178862 -5.083895\nCe Si Au\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.385473 0.385473 0.000000 Si\n0.614528 0.614528 0.000000 Si\n0.750000 0.250000 0.500000 Au\n0.250000 0.750000 0.500000 Au\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Si",
"Au"
],
"chemical_system": "Au-Ce-Si",
"density": 10.151894777178383,
"density_atomic": 0.05179096358620383,
"volume": 96.54193808689648,
"volume_molar": 11.627782808049915,
"formula_full": "Ce1 Si2 Au2",
"formula_reduced": "Ce(SiAu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.872923568,
"spacegroup": 139
},
{
"id": "jvasp-92573",
"created_at": "2022-09-04T14:35:55.676343Z",
"updated_at": "2022-09-04T14:35:55.676374Z",
"structure_string": "Sm2 Bi1 O2\n1.0\n3.962539 -0.000000 0.000000\n-0.000000 3.962539 0.000000\n-1.981271 -1.981271 6.869360\nSm Bi O\n2 1 2\ndirect\n0.665561 0.665561 0.331123 Sm\n0.334439 0.334439 0.668877 Sm\n0.000000 0.000000 0.000000 Bi\n0.250000 0.750000 0.500000 O\n0.750000 0.250000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Bi",
"O"
],
"chemical_system": "Bi-O-Sm",
"density": 8.339574937223396,
"density_atomic": 0.04635607193797143,
"volume": 107.8607351953903,
"volume_molar": 12.991050596474532,
"formula_full": "Sm2 Bi1 O2",
"formula_reduced": "Sm2BiO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.31077181,
"spacegroup": 139
},
{
"id": "jvasp-92380",
"created_at": "2022-09-04T14:35:56.709133Z",
"updated_at": "2022-09-04T14:35:56.709163Z",
"structure_string": "Dy1 Ni2 P2\n1.0\n3.634960 0.000000 -1.386196\n-0.528627 3.596316 -1.386196\n-0.006925 -0.008017 5.440837\nDy Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.749999 0.250000 0.499999 Ni\n0.249999 0.750000 0.499999 Ni\n0.623387 0.623389 0.246777 P\n0.376609 0.376610 0.753222 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Dy",
"Ni",
"P"
],
"chemical_system": "Dy-Ni-P",
"density": 7.989786545108925,
"density_atomic": 0.07037856624606803,
"volume": 71.04435720554828,
"volume_molar": 8.55678238591064,
"formula_full": "Dy1 Ni2 P2",
"formula_reduced": "Dy(NiP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.80829046,
"spacegroup": 139
},
{
"id": "jvasp-15269",
"created_at": "2022-09-04T14:35:56.839214Z",
"updated_at": "2022-09-04T14:35:56.839241Z",
"structure_string": "Al1 Fe2 B2\n1.0\n2.837777 0.000000 0.000000\n0.000000 2.817382 -0.746445\n0.000000 0.006878 5.716141\nAl Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.645544 0.291089 Fe\n0.500001 0.354456 0.708912 Fe\n0.000000 0.793220 0.586440 B\n0.000000 0.206780 0.413560 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Fe",
"B"
],
"chemical_system": "Al-B-Fe",
"density": 5.822369349554082,
"density_atomic": 0.10937161939926567,
"volume": 45.71569871108236,
"volume_molar": 5.506127451597772,
"formula_full": "Al1 Fe2 B2",
"formula_reduced": "Al(FeB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.655031793333333,
"spacegroup": 65
}
]
}