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_reduced&page=1142",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=1140",
"results": [
{
"id": "jvasp-79412",
"created_at": "2022-09-04T14:37:17.166197Z",
"updated_at": "2022-09-04T14:37:17.166227Z",
"structure_string": "Cu3 Si1\n1.0\n-1.832124 1.832124 3.649965\n1.832124 -1.832124 3.649965\n1.832124 1.832124 -3.649965\nCu Si\n3 1\ndirect\n0.749999 0.250000 0.499998 Cu\n0.250000 0.749999 0.499998 Cu\n0.500002 0.500002 0.000000 Cu\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Si"
],
"chemical_system": "Cu-Si",
"density": 7.411158907712075,
"density_atomic": 0.08162093630065996,
"volume": 49.00703399512041,
"volume_molar": 7.378181423718006,
"formula_full": "Cu3 Si1",
"formula_reduced": "Cu3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4713874874999999,
"spacegroup": 139
},
{
"id": "jvasp-19859",
"created_at": "2022-09-04T14:36:12.184286Z",
"updated_at": "2022-09-04T14:36:12.184316Z",
"structure_string": "Cu3 Sn1\n1.0\n3.787604 0.000000 2.186774\n1.262535 3.570987 2.186774\n0.000000 0.000000 4.373547\nCu Sn\n3 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.499999 0.500000 0.500000 Cu\n0.749998 0.750001 0.750000 Cu\n0.249999 0.250000 0.250000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Sn"
],
"chemical_system": "Cu-Sn",
"density": 8.683799276905681,
"density_atomic": 0.06761971836919493,
"volume": 59.1543427933331,
"volume_molar": 8.905894471668589,
"formula_full": "Cu3 Sn1",
"formula_reduced": "Cu3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0157775,
"spacegroup": 225
},
{
"id": "jvasp-17181",
"created_at": "2022-09-04T14:38:15.042875Z",
"updated_at": "2022-09-04T14:38:15.042894Z",
"structure_string": "Cu6 Sn2\n1.0\n2.815269 -4.876189 -0.000000\n2.815269 4.876189 0.000000\n-0.000000 0.000000 4.302740\nCu Sn\n6 2\ndirect\n0.154306 0.845694 0.250000 Cu\n0.845694 0.691389 0.750000 Cu\n0.308612 0.154306 0.750000 Cu\n0.691389 0.845694 0.250000 Cu\n0.154306 0.308612 0.250000 Cu\n0.845694 0.154306 0.750000 Cu\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"Sn"
],
"chemical_system": "Cu-Sn",
"density": 8.696627680710154,
"density_atomic": 0.06771961163304453,
"volume": 118.13416833147213,
"volume_molar": 8.892757378220743,
"formula_full": "Cu6 Sn2",
"formula_reduced": "Cu3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-51908",
"created_at": "2022-09-04T14:37:16.150057Z",
"updated_at": "2022-09-04T14:37:16.150076Z",
"structure_string": "Cu3 Sn4 Pb1 O12\n1.0\n6.753336 -0.002230 0.001847\n-2.249049 6.367857 -0.002984\n-2.253622 -3.180728 5.514561\nCu Sn Pb O\n3 4 1 12\ndirect\n0.000014 0.500018 0.499986 Cu\n0.499974 0.499957 0.000013 Cu\n0.499984 0.000006 0.499984 Cu\n0.999987 0.500016 -0.000006 Sn\n-0.000013 0.999990 0.499978 Sn\n0.500033 0.999987 0.999993 Sn\n0.500039 0.500045 0.500050 Sn\n0.000155 0.000119 0.000052 Pb\n0.312174 0.173185 0.485353 O\n0.173190 0.485369 0.312172 O\n0.826842 0.514638 0.687804 O\n0.687786 0.173189 0.860973 O\n0.514576 0.687750 0.826815 O\n0.312173 0.826839 0.138994 O\n0.138980 0.312135 0.826846 O\n0.485326 0.312145 0.173192 O\n0.860963 0.687758 0.173207 O\n0.687790 0.826824 0.514602 O\n0.826836 0.139028 0.312194 O\n0.173207 0.861008 0.687808 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Cu",
"Sn",
"Pb",
"O"
],
"chemical_system": "Cu-O-Pb-Sn",
"density": 7.456536864490224,
"density_atomic": 0.08435342567037088,
"volume": 237.09766190355202,
"volume_molar": 7.1391774692503995,
"formula_full": "Cu3 Sn4 Pb1 O12",
"formula_reduced": "Cu3Sn4PbO12",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 1.8011180485000002,
"spacegroup": 204
},
{
"id": "jvasp-122030",
"created_at": "2022-09-04T14:38:51.881106Z",
"updated_at": "2022-09-04T14:38:51.881117Z",
"structure_string": "Cu3 Sn1 P4 O16\n1.0\n6.015109 -0.000000 0.000000\n0.000000 4.936217 0.219020\n-0.000000 0.016040 9.909419\nCu Sn P O\n3 1 4 16\ndirect\n0.500000 0.870901 0.306239 Cu\n0.500000 0.653664 0.809785 Cu\n-0.000000 0.369302 0.199335 Cu\n-0.000000 0.062487 0.707093 Sn\n-0.000000 0.888385 0.393497 P\n-0.000000 0.590154 0.903724 P\n0.500000 0.422029 0.109179 P\n0.500000 0.104321 0.592955 P\n0.706510 0.250908 0.653697 O\n-0.000000 0.199567 0.373507 O\n-0.000000 0.289283 0.874283 O\n0.299396 0.264262 0.172057 O\n0.700604 0.264262 0.172057 O\n0.500000 0.399131 0.953362 O\n-0.000000 0.629106 0.054494 O\n0.500000 0.799963 0.633438 O\n0.192754 0.757063 0.828609 O\n0.500000 0.727346 0.134303 O\n0.293490 0.250908 0.653697 O\n0.798548 0.749274 0.329027 O\n0.201452 0.749274 0.329027 O\n-0.000000 0.820358 0.549561 O\n0.807246 0.757063 0.828609 O\n0.500000 0.130995 0.438464 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cu",
"Sn",
"P",
"O"
],
"chemical_system": "Cu-O-P-Sn",
"density": 3.8900993935472177,
"density_atomic": 0.08157488999783222,
"volume": 294.2081809811546,
"volume_molar": 7.382346160883618,
"formula_full": "Cu3 Sn1 P4 O16",
"formula_reduced": "Cu3Sn(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 2.567483793750001,
"spacegroup": 6
},
{
"id": "jvasp-29696",
"created_at": "2022-09-04T14:37:51.679003Z",
"updated_at": "2022-09-04T14:37:51.679025Z",
"structure_string": "Cu3 Te2 Br2 O6\n1.0\n5.522255 0.044775 1.377112\n1.890726 5.188687 1.377112\n-0.009539 -0.006735 8.152547\nCu Te Br O\n3 2 2 6\ndirect\n0.089788 0.089789 0.634678 Cu\n0.500001 0.500000 0.500000 Cu\n0.910213 0.910212 0.365322 Cu\n0.333376 0.333376 0.233631 Te\n0.666625 0.666625 0.766369 Te\n0.205520 0.205521 0.866680 Br\n0.794481 0.794480 0.133319 Br\n0.861571 0.861570 0.628894 O\n0.222264 0.611841 0.367706 O\n0.777737 0.388159 0.632293 O\n0.611841 0.222264 0.367706 O\n0.388160 0.777737 0.632293 O\n0.138430 0.138431 0.371106 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Cu",
"Te",
"Br",
"O"
],
"chemical_system": "Br-Cu-O-Te",
"density": 5.000275788184294,
"density_atomic": 0.055792058802851055,
"volume": 233.00807102203012,
"volume_molar": 10.793903091621097,
"formula_full": "Cu3 Te2 Br2 O6",
"formula_reduced": "Cu3Te2(BrO3)2",
"formula_anonymous": "A2B2C3D6",
"energy_above_hull": 1.3430112379487178,
"spacegroup": 12
},
{
"id": "jvasp-34704",
"created_at": "2022-09-04T14:38:13.686517Z",
"updated_at": "2022-09-04T14:38:13.686533Z",
"structure_string": "Cu3 Te1 S3 Cl1\n1.0\n5.455532 -0.033757 0.507699\n0.459522 5.436250 0.507699\n-0.036960 -0.033757 5.478981\nCu Te S Cl\n3 1 3 1\ndirect\n0.770174 0.770174 0.195733 Cu\n0.770174 0.195731 0.770175 Cu\n0.195732 0.770174 0.770175 Cu\n0.254971 0.254971 0.254971 Te\n0.470552 0.971687 0.971688 S\n0.971687 0.470551 0.971688 S\n0.971687 0.971687 0.470553 S\n0.567689 0.567689 0.567690 Cl\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cu",
"Te",
"S",
"Cl"
],
"chemical_system": "Cl-Cu-S-Te",
"density": 4.589713096487862,
"density_atomic": 0.04915004836712789,
"volume": 162.7668795001734,
"volume_molar": 12.252563242700033,
"formula_full": "Cu3 Te1 S3 Cl1",
"formula_reduced": "Cu3TeS3Cl",
"formula_anonymous": "ABC3D3",
"energy_above_hull": 0.7565078980208334,
"spacegroup": 160
},
{
"id": "jvasp-91334",
"created_at": "2022-09-04T14:36:17.959308Z",
"updated_at": "2022-09-04T14:36:17.959339Z",
"structure_string": "Cu4 Bi5 S10\n1.0\n3.903982 -0.000000 -0.000000\n-1.951991 8.366186 -2.713180\n-0.000000 0.024426 12.935025\nCu Bi S\n4 5 10\ndirect\n0.711494 0.422987 0.057341 Cu\n0.288507 0.577014 0.942659 Cu\n0.902970 0.805941 0.485405 Cu\n0.097030 0.194060 0.514595 Cu\n0.000000 0.000000 0.000000 Bi\n0.804084 0.608168 0.663995 Bi\n0.410885 0.821770 0.224196 Bi\n0.589115 0.178231 0.775804 Bi\n0.195916 0.391833 0.336005 Bi\n0.021963 0.043925 0.633719 S\n0.760246 0.520491 0.241462 S\n0.239754 0.479510 0.758538 S\n0.335180 0.670361 0.497142 S\n0.664820 0.329640 0.502858 S\n0.846805 0.693612 0.028178 S\n0.153195 0.306389 0.971822 S\n0.978037 0.956076 0.366281 S\n0.455932 0.911864 0.832283 S\n0.544068 0.088137 0.167717 S\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"S"
],
"chemical_system": "Bi-Cu-S",
"density": 6.362456944085118,
"density_atomic": 0.044945387080935456,
"volume": 422.7352623704348,
"volume_molar": 13.398796074790997,
"formula_full": "Cu4 Bi5 S10",
"formula_reduced": "Cu4(BiS2)5",
"formula_anonymous": "A4B5C10",
"energy_above_hull": 1.424574910526316,
"spacegroup": 12
},
{
"id": "jvasp-107347",
"created_at": "2022-09-04T14:36:54.694422Z",
"updated_at": "2022-09-04T14:36:54.694433Z",
"structure_string": "Cu4 Br3 Cl1\n1.0\n4.854682 -0.005407 -4.323089\n-0.980167 4.754707 -4.323089\n0.004411 0.005407 6.500539\nCu Br Cl\n4 3 1\ndirect\n-0.000000 0.500001 0.500000 Cu\n0.261073 0.261073 -0.000000 Cu\n0.500000 -0.000000 0.500000 Cu\n0.738926 0.738927 -0.000001 Cu\n0.749999 0.250000 0.500000 Br\n0.000000 0.000000 0.000000 Br\n0.250000 0.750001 0.500000 Br\n0.500000 0.500000 -0.000000 Cl\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-Cu",
"density": 5.85059277087121,
"density_atomic": 0.05324743140393301,
"volume": 150.24198893862695,
"volume_molar": 11.30973006813468,
"formula_full": "Cu4 Br3 Cl1",
"formula_reduced": "Cu4Br3Cl",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-97492",
"created_at": "2022-09-04T14:36:14.903300Z",
"updated_at": "2022-09-04T14:36:14.903314Z",
"structure_string": "Cu8 H6 C4 N10\n1.0\n5.637945 0.000000 -0.000000\n-2.818972 4.882603 0.000000\n-0.000000 0.000000 10.938214\nCu H C N\n8 6 4 10\ndirect\n0.831788 0.663577 0.236312 Cu\n0.336422 0.168211 0.236312 Cu\n0.831788 0.168211 0.236312 Cu\n0.666666 0.333333 0.749527 Cu\n0.663577 0.831788 0.736312 Cu\n0.168211 0.336422 0.736312 Cu\n0.333333 0.666667 0.249527 Cu\n0.168211 0.831788 0.736312 Cu\n0.234949 0.469898 0.037079 H\n0.530101 0.765050 0.037079 H\n0.234949 0.765050 0.037079 H\n0.469898 0.234949 0.537079 H\n0.765050 0.234949 0.537079 H\n0.765050 0.530101 0.537079 H\n0.666666 0.333333 0.027307 C\n0.000000 0.000000 0.942103 C\n0.333333 0.666667 0.527307 C\n0.000000 0.000000 0.442103 C\n0.333333 0.666667 0.418897 N\n0.666666 0.333333 0.144854 N\n0.000000 0.000000 0.324502 N\n0.666666 0.333333 0.918896 N\n0.000000 0.000000 0.824502 N\n0.000000 0.000000 0.551319 N\n0.666666 0.333333 0.570518 N\n0.333333 0.666667 0.070518 N\n0.000000 0.000000 0.051319 N\n0.333333 0.666667 0.644854 N\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Cu",
"H",
"C",
"N"
],
"chemical_system": "C-Cu-H-N",
"density": 3.874293239569672,
"density_atomic": 0.09299066789431851,
"volume": 301.10548331388776,
"volume_molar": 6.476070014728797,
"formula_full": "Cu8 H6 C4 N10",
"formula_reduced": "Cu4H3C2N5",
"formula_anonymous": "A2B3C4D5",
"energy_above_hull": 3.8766748607142874,
"spacegroup": 186
},
{
"id": "jvasp-102773",
"created_at": "2022-09-04T14:36:48.992367Z",
"updated_at": "2022-09-04T14:36:48.992394Z",
"structure_string": "Cu4 I3 Cl1\n1.0\n3.967177 -0.000000 0.000000\n0.000000 5.569594 0.000000\n-0.000000 0.000000 7.915787\nCu I Cl\n4 3 1\ndirect\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.770485 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.229516 Cu\n0.500000 0.000000 0.240258 I\n-0.000000 0.500000 0.500000 I\n0.500000 0.000000 0.759742 I\n-0.000000 0.500000 -0.000000 Cl\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"I",
"Cl"
],
"chemical_system": "Cl-Cu-I",
"density": 6.364316390797854,
"density_atomic": 0.04573943249746624,
"volume": 174.9037878955574,
"volume_molar": 13.166190377052885,
"formula_full": "Cu4 I3 Cl1",
"formula_reduced": "Cu4I3Cl",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.0,
"spacegroup": 47
},
{
"id": "jvasp-57653",
"created_at": "2022-09-04T14:38:34.633600Z",
"updated_at": "2022-09-04T14:38:34.633627Z",
"structure_string": "Cu8 O6\n1.0\n5.267627 -0.000000 -2.670111\n-1.353454 5.090781 -2.670111\n-0.032783 -0.042637 6.466399\nCu O\n8 6\ndirect\n0.500001 0.500000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000001 0.500000 0.500000 Cu\n0.500001 0.500000 0.000000 Cu\n0.000000 0.500000 0.000000 Cu\n0.000000 -0.000000 0.500000 Cu\n0.500001 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.625001 0.375000 0.250000 O\n0.375001 0.624999 0.750000 O\n0.637976 0.887974 0.275950 O\n0.887976 0.637974 0.775950 O\n0.362026 0.112025 0.724051 O\n0.112026 0.362025 0.224051 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Cu",
"O"
],
"chemical_system": "Cu-O",
"density": 5.827742877607641,
"density_atomic": 0.08129810939862854,
"volume": 172.2057265975754,
"volume_molar": 7.407479466061963,
"formula_full": "Cu8 O6",
"formula_reduced": "Cu4O3",
"formula_anonymous": "A3B4",
"energy_above_hull": 0.8993476785714287,
"spacegroup": 141
}
]
}