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=-nelements&page=613",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=611",
"results": [
{
"id": "jvasp-57098",
"created_at": "2022-09-04T14:37:04.111133Z",
"updated_at": "2022-09-04T14:37:04.111163Z",
"structure_string": "Na2 Cd1 Sn1 S4\n1.0\n5.630585 0.019669 -3.215232\n-1.857507 5.312405 -3.220397\n0.177698 0.257963 6.850640\nNa Cd Sn S\n2 1 1 4\ndirect\n0.514043 0.014043 0.028085 Na\n0.764116 0.764116 0.528232 Na\n0.014180 0.514181 0.028360 Cd\n0.264127 0.264127 0.528254 Sn\n0.925018 0.375761 0.279952 S\n0.624114 0.603192 0.776533 S\n0.152420 0.173340 0.776533 S\n0.354934 0.904192 0.279952 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Na",
"Cd",
"Sn",
"S"
],
"chemical_system": "Cd-Na-S-Sn",
"density": 3.139415009871474,
"density_atomic": 0.03731196759743385,
"volume": 214.40841947317207,
"volume_molar": 16.13997102745709,
"formula_full": "Na2 Cd1 Sn1 S4",
"formula_reduced": "Na2CdSnS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.57481368125,
"spacegroup": 82
},
{
"id": "jvasp-103791",
"created_at": "2022-09-04T14:36:58.983588Z",
"updated_at": "2022-09-04T14:36:58.983607Z",
"structure_string": "H8 C6 S2 O2\n1.0\n4.692094 -0.084760 1.114895\n0.934464 5.437794 1.548088\n0.192656 -0.032521 6.999779\nH C S O\n8 6 2 2\ndirect\n0.354781 0.956668 0.850772 H\n0.570761 0.461517 0.689388 H\n0.487799 0.305526 0.946424 H\n0.430903 0.109097 0.591347 H\n0.354666 0.456649 0.350777 H\n0.570634 0.961498 0.189398 H\n0.487677 0.805509 0.446433 H\n0.430759 0.609091 0.091358 H\n0.862929 0.132351 0.768103 C\n0.862806 0.632337 0.268107 C\n0.359476 0.637016 0.246670 C\n0.561711 0.277932 0.790219 C\n0.359601 0.137033 0.746657 C\n0.561589 0.777914 0.290229 C\n0.935511 0.344156 0.249112 S\n0.935617 0.844155 0.749143 S\n0.062639 0.265700 0.768252 O\n0.062513 0.765673 0.268280 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.6427945763902037,
"density_atomic": 0.10103258777587025,
"volume": 178.16033812705098,
"volume_molar": 5.9605924113905315,
"formula_full": "H8 C6 S2 O2",
"formula_reduced": "H4C3SO",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 4.277704833333332,
"spacegroup": 1
},
{
"id": "jvasp-103091",
"created_at": "2022-09-04T14:36:45.279083Z",
"updated_at": "2022-09-04T14:36:45.279101Z",
"structure_string": "Hf1 Ta1 C1 N1\n1.0\n3.057540 -0.000228 4.632408\n1.390771 2.722922 4.632408\n-0.000373 -0.000228 5.550473\nHf Ta C N\n1 1 1 1\ndirect\n0.747459 0.747456 0.747458 Hf\n0.253307 0.253306 0.253307 Ta\n0.997840 0.997837 0.997840 C\n0.501398 0.501396 0.501398 N\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Hf",
"Ta",
"C",
"N"
],
"chemical_system": "C-Hf-N-Ta",
"density": 13.84868232534936,
"density_atomic": 0.08654567070151306,
"volume": 46.21837195988209,
"volume_molar": 6.958338541011176,
"formula_full": "Hf1 Ta1 C1 N1",
"formula_reduced": "HfTaCN",
"formula_anonymous": "ABCD",
"energy_above_hull": 5.5294863625,
"spacegroup": 160
},
{
"id": "jvasp-103941",
"created_at": "2022-09-04T14:36:50.883609Z",
"updated_at": "2022-09-04T14:36:50.883632Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.593207 -0.190341 1.130152\n-0.293051 5.854484 1.670779\n0.014021 -0.034117 7.148473\nMg H C O\n2 4 6 8\ndirect\n0.336093 0.142048 0.596092 Mg\n0.064401 0.212487 0.115880 Mg\n0.455521 0.677339 0.650010 H\n0.298896 0.834765 0.031764 H\n0.792987 0.601517 0.534481 H\n0.622159 0.694397 0.060965 H\n0.425002 0.757558 0.138609 C\n0.669771 0.636879 0.673443 C\n0.527298 0.927327 0.233390 C\n0.246078 0.546713 0.289189 C\n0.626100 0.411232 0.836509 C\n0.829243 0.851262 0.684378 C\n0.392944 0.278036 0.857659 O\n0.802343 0.359402 0.942144 O\n0.319662 0.463387 0.451438 O\n0.722210 0.039826 0.623368 O\n0.792707 0.936918 0.235286 O\n0.068433 0.849416 0.736952 O\n0.342949 0.054889 0.306388 O\n0.040448 0.459840 0.239343 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 2.1854565184962684,
"density_atomic": 0.10416356445528209,
"volume": 192.00571816631808,
"volume_molar": 5.781427307612282,
"formula_full": "Mg2 H4 C6 O8",
"formula_reduced": "MgH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.715072305,
"spacegroup": 1
},
{
"id": "jvasp-99405",
"created_at": "2022-09-04T14:36:44.732306Z",
"updated_at": "2022-09-04T14:36:44.732325Z",
"structure_string": "La1 Mn2 Cd1 O6\n1.0\n4.699746 0.000335 2.681263\n1.557393 4.434202 2.681263\n0.000473 0.000335 5.410803\nLa Mn Cd O\n1 2 1 6\ndirect\n0.499999 0.500001 0.499999 La\n0.249515 0.249516 0.249515 Mn\n0.750484 0.750486 0.750483 Mn\n0.000000 0.000000 0.000000 Cd\n0.579083 0.420917 -0.000001 O\n-0.000001 0.579083 0.420917 O\n0.420916 0.000001 0.579082 O\n0.500000 0.942038 0.057961 O\n0.057961 0.500001 0.942037 O\n0.942038 0.057964 0.499999 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Mn",
"Cd",
"O"
],
"chemical_system": "Cd-La-Mn-O",
"density": 6.733434710141175,
"density_atomic": 0.08869350571534594,
"volume": 112.7478265668529,
"volume_molar": 6.7898328196965565,
"formula_full": "La1 Mn2 Cd1 O6",
"formula_reduced": "LaMn2CdO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.522830023275862,
"spacegroup": 155
},
{
"id": "jvasp-106736",
"created_at": "2022-09-04T14:36:50.741737Z",
"updated_at": "2022-09-04T14:36:50.741755Z",
"structure_string": "Sr2 Nb1 Ga1 O6\n1.0\n4.880396 0.000000 2.817698\n1.626799 4.601281 2.817698\n0.000000 0.000000 5.635396\nSr Nb Ga O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750001 0.750000 0.750001 Sr\n0.000000 0.000000 0.000000 Nb\n0.500001 0.500000 0.500001 Ga\n0.748812 0.251189 0.251189 O\n0.251190 0.748811 0.748812 O\n0.251189 0.251189 0.748812 O\n0.748812 0.748811 0.251189 O\n0.251190 0.748811 0.251189 O\n0.748812 0.251189 0.748812 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Nb",
"Ga",
"O"
],
"chemical_system": "Ga-Nb-O-Sr",
"density": 5.693066238463224,
"density_atomic": 0.0790208581462157,
"volume": 126.54886614236165,
"volume_molar": 7.620950849277,
"formula_full": "Sr2 Nb1 Ga1 O6",
"formula_reduced": "Sr2NbGaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.9124185345,
"spacegroup": 225
},
{
"id": "jvasp-104980",
"created_at": "2022-09-04T14:36:58.976934Z",
"updated_at": "2022-09-04T14:36:58.976946Z",
"structure_string": "Hf1 Cr1 Cu1 S4\n1.0\n6.106691 0.025076 2.876719\n5.083413 3.383965 2.876719\n-0.000762 -0.000232 5.926536\nHf Cr Cu S\n1 1 1 4\ndirect\n0.245570 0.245572 0.745369 Hf\n0.756453 0.756458 0.262227 Cr\n0.498422 0.498425 0.480596 Cu\n0.375569 0.375571 0.277831 S\n0.619612 0.619616 0.701714 S\n0.871380 0.871385 0.812987 S\n0.132983 0.132984 0.219279 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Hf",
"Cr",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-Hf-S",
"density": 5.760867264557247,
"density_atomic": 0.05750741608753819,
"volume": 121.72343110225212,
"volume_molar": 10.471937655541776,
"formula_full": "Hf1 Cr1 Cu1 S4",
"formula_reduced": "HfCrCuS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.710754407142858,
"spacegroup": 8
},
{
"id": "jvasp-103907",
"created_at": "2022-09-04T14:37:04.042723Z",
"updated_at": "2022-09-04T14:37:04.042748Z",
"structure_string": "Zn1 H4 C4 O4\n1.0\n3.606115 -0.051682 0.104947\n-0.386197 4.595353 -1.060417\n0.767337 0.386479 7.279930\nZn H C O\n1 4 4 4\ndirect\n0.480453 0.603748 0.280277 Zn\n0.950196 0.064489 0.767964 H\n0.399970 0.162735 0.829201 H\n0.809549 0.550736 0.776367 H\n0.282956 0.666228 0.717951 H\n0.349966 0.136274 0.538876 C\n0.197468 0.214609 0.743282 C\n0.096368 0.528720 0.800894 C\n0.150377 0.623434 0.003189 C\n0.522763 0.904184 0.498911 O\n0.292437 0.287488 0.421984 O\n0.414313 0.807423 0.049331 O\n-0.033531 0.481791 0.130066 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.4777041266596775,
"density_atomic": 0.10688386564640655,
"volume": 121.62733749737897,
"volume_molar": 5.634284205178786,
"formula_full": "Zn1 H4 C4 O4",
"formula_reduced": "ZnH4(CO)4",
"formula_anonymous": "AB4C4D4",
"energy_above_hull": 3.961311107692308,
"spacegroup": 1
},
{
"id": "jvasp-8111",
"created_at": "2022-09-04T14:37:05.684430Z",
"updated_at": "2022-09-04T14:37:05.684459Z",
"structure_string": "La2 Ag2 S2 O2\n1.0\n4.077793 -0.000000 0.000000\n0.000000 4.077793 0.000000\n0.000000 -0.000000 9.042828\nLa Ag S O\n2 2 2 2\ndirect\n0.500000 0.000000 0.863156 La\n0.000000 0.500000 0.136845 La\n0.000000 0.000000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.500000 0.000000 0.305017 S\n0.000000 0.500000 0.694983 S\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Ag",
"S",
"O"
],
"chemical_system": "Ag-La-O-S",
"density": 6.511904613498681,
"density_atomic": 0.053202907225290856,
"volume": 150.36772269085836,
"volume_molar": 11.319194897562436,
"formula_full": "La2 Ag2 S2 O2",
"formula_reduced": "LaAgSO",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.93523644,
"spacegroup": 129
},
{
"id": "jvasp-107099",
"created_at": "2022-09-04T14:36:58.957067Z",
"updated_at": "2022-09-04T14:36:58.957088Z",
"structure_string": "Rb2 Hg1 Ir1 F6\n1.0\n5.720899 -0.000000 3.302962\n1.906966 5.393715 3.302962\n-0.000000 -0.000000 6.605925\nRb Hg Ir F\n2 1 1 6\ndirect\n0.750001 0.749999 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.499999 Hg\n0.000000 0.000000 0.000000 Ir\n0.787045 0.212955 0.212954 F\n0.212955 0.212955 0.787044 F\n0.212956 0.787044 0.787044 F\n0.212956 0.787044 0.212954 F\n0.787045 0.212955 0.787044 F\n0.787046 0.787044 0.212954 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Hg",
"Ir",
"F"
],
"chemical_system": "F-Hg-Ir-Rb",
"density": 5.521051883094404,
"density_atomic": 0.049058479744714716,
"volume": 203.83835887367349,
"volume_molar": 12.275432894246569,
"formula_full": "Rb2 Hg1 Ir1 F6",
"formula_reduced": "Rb2HgIrF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-49368",
"created_at": "2022-09-04T14:37:03.367848Z",
"updated_at": "2022-09-04T14:37:03.367869Z",
"structure_string": "Y6 Cu2 Sn2 S14\n1.0\n4.870791 -8.436457 0.000000\n4.870791 8.436457 -0.000000\n0.000000 0.000000 6.234612\nY Cu Sn S\n6 2 2 14\ndirect\n0.848189 0.639953 0.125680 Y\n0.208235 0.848189 0.625679 Y\n0.791765 0.151810 0.125680 Y\n0.151811 0.360047 0.625679 Y\n0.639953 0.791765 0.625679 Y\n0.360047 0.208235 0.125680 Y\n0.000000 0.000000 0.011361 Cu\n0.000000 0.000000 0.511361 Cu\n0.666667 0.333333 0.689177 Sn\n0.333333 0.666667 0.189177 Sn\n0.883503 0.736622 0.547450 S\n0.146881 0.883503 0.047450 S\n0.116497 0.263378 0.047450 S\n0.853119 0.116497 0.547450 S\n0.080717 0.560506 0.371993 S\n0.560506 0.479789 0.871993 S\n0.666667 0.333333 0.303894 S\n0.479789 0.919283 0.371993 S\n0.439494 0.520211 0.371993 S\n0.919283 0.439494 0.871993 S\n0.263378 0.146881 0.547450 S\n0.333333 0.666667 0.803894 S\n0.520211 0.080717 0.871993 S\n0.736622 0.853119 0.047450 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Y",
"Cu",
"Sn",
"S"
],
"chemical_system": "Cu-S-Sn-Y",
"density": 4.3648728642667445,
"density_atomic": 0.04683949701366694,
"volume": 512.3880812169529,
"volume_molar": 12.856971453478343,
"formula_full": "Y6 Cu2 Sn2 S14",
"formula_reduced": "Y3CuSnS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.103957375,
"spacegroup": 173
},
{
"id": "jvasp-49375",
"created_at": "2022-09-04T14:36:58.931535Z",
"updated_at": "2022-09-04T14:36:58.931556Z",
"structure_string": "Nd6 Si2 Ag2 Se14\n1.0\n5.359646 -9.283179 -0.000000\n5.359646 9.283179 0.000000\n0.000000 0.000000 6.052541\nNd Si Ag Se\n6 2 2 14\ndirect\n0.230746 0.873159 0.533255 Nd\n0.873159 0.642414 0.033255 Nd\n0.357587 0.230746 0.033255 Nd\n0.642414 0.769255 0.533255 Nd\n0.126842 0.357587 0.533255 Nd\n0.769255 0.126842 0.033255 Nd\n0.666667 0.333333 0.621241 Si\n0.333333 0.666667 0.121241 Si\n0.000000 0.000000 0.492464 Ag\n0.000000 0.000000 0.992464 Ag\n0.824649 0.096173 0.517940 Se\n0.728476 0.824649 0.017940 Se\n0.333333 0.666667 0.746179 Se\n0.666667 0.333333 0.246179 Se\n0.106974 0.584987 0.272391 Se\n0.521988 0.106974 0.772391 Se\n0.584987 0.478013 0.772391 Se\n0.271524 0.175352 0.517940 Se\n0.478013 0.893027 0.272391 Se\n0.893027 0.415014 0.772391 Se\n0.903828 0.728477 0.517940 Se\n0.415014 0.521988 0.272391 Se\n0.175352 0.903828 0.017940 Se\n0.096172 0.271524 0.017940 Se\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Nd",
"Si",
"Ag",
"Se"
],
"chemical_system": "Ag-Nd-Se-Si",
"density": 6.183565457333334,
"density_atomic": 0.03984838047907864,
"volume": 602.2829462944065,
"volume_molar": 15.112636166385155,
"formula_full": "Nd6 Si2 Ag2 Se14",
"formula_reduced": "Nd3SiAgSe7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.6646769938888886,
"spacegroup": 173
}
]
}