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=1102",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=1100",
"results": [
{
"id": "jvasp-42470",
"created_at": "2022-09-04T14:36:50.746526Z",
"updated_at": "2022-09-04T14:36:50.746552Z",
"structure_string": "Cr2 Cu2 O4\n1.0\n0.000000 5.195754 0.000442\n2.999837 0.000000 0.000000\n0.000000 -1.730684 -5.716858\nCr Cu O\n2 2 4\ndirect\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500001 0.500000 Cr\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500001 0.000000 Cu\n0.108263 0.000000 0.324738 O\n0.891738 0.000000 0.675263 O\n0.608262 0.500001 0.324738 O\n0.391738 0.500001 0.675262 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-O",
"density": 5.499194280763474,
"density_atomic": 0.08978370617717285,
"volume": 89.10302704828605,
"volume_molar": 6.707387137835824,
"formula_full": "Cr2 Cu2 O4",
"formula_reduced": "CrCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8983312125,
"spacegroup": 166
},
{
"id": "jvasp-27049",
"created_at": "2022-09-04T14:38:33.003780Z",
"updated_at": "2022-09-04T14:38:33.003803Z",
"structure_string": "Cr1 Cu1 O2\n1.0\n2.910564 0.005153 5.216017\n1.360792 2.572869 5.216017\n0.008537 0.005153 5.973119\nCr Cu O\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Cr\n0.000000 0.000000 0.000000 Cu\n0.891761 0.891756 0.891762 O\n0.108240 0.108241 0.108240 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-O",
"density": 5.501625804868007,
"density_atomic": 0.08982340494659581,
"volume": 44.531823330213165,
"volume_molar": 6.704422709849891,
"formula_full": "Cr1 Cu1 O2",
"formula_reduced": "CrCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8983337124999995,
"spacegroup": 166
},
{
"id": "jvasp-42945",
"created_at": "2022-09-04T14:38:08.784453Z",
"updated_at": "2022-09-04T14:38:08.784477Z",
"structure_string": "Cr2 Cu2 O4\n1.0\n0.000000 5.195646 0.000457\n2.999831 0.000000 0.000000\n0.000000 -1.730664 -5.716941\nCr Cu O\n2 2 4\ndirect\n0.500001 0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.108263 0.000000 0.324735 O\n0.891738 0.000000 0.675264 O\n0.608263 0.500000 0.324735 O\n0.391738 0.500000 0.675265 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-O",
"density": 5.499244554827038,
"density_atomic": 0.08978452698682621,
"volume": 89.1022124689014,
"volume_molar": 6.707325818939392,
"formula_full": "Cr2 Cu2 O4",
"formula_reduced": "CrCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8983312125,
"spacegroup": 166
},
{
"id": "jvasp-90643",
"created_at": "2022-09-04T14:36:07.158697Z",
"updated_at": "2022-09-04T14:36:07.158714Z",
"structure_string": "Cr2 Cu2 O4\n1.0\n-1.499754 2.597650 0.000000\n0.000000 -0.000000 11.434072\n2.999507 0.000000 -0.000000\nCr Cu O\n2 2 4\ndirect\n0.000000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n0.333333 0.750000 0.666667 Cu\n0.666666 0.250000 0.333334 Cu\n0.666666 0.412371 0.333334 O\n0.333333 0.912370 0.666667 O\n0.333333 0.587630 0.666667 O\n0.666666 0.087630 0.333334 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-O",
"density": 5.499967003111742,
"density_atomic": 0.08979632218466983,
"volume": 89.09050844585451,
"volume_molar": 6.706444778011309,
"formula_full": "Cr2 Cu2 O4",
"formula_reduced": "CrCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8984237125,
"spacegroup": 194
},
{
"id": "jvasp-22557",
"created_at": "2022-09-04T14:35:48.676945Z",
"updated_at": "2022-09-04T14:35:48.676974Z",
"structure_string": "Cr1 Cu1 O2\n1.0\n2.876673 0.139342 5.610588\n1.463730 2.480355 5.610587\n0.230866 0.139342 6.300845\nCr Cu O\n1 1 2\ndirect\n0.500001 0.499999 0.500001 Cr\n0.000000 0.000000 0.000000 Cu\n0.897213 0.897204 0.897210 O\n0.102790 0.102791 0.102790 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"O"
],
"chemical_system": "Cr-Cu-O",
"density": 6.196887435313952,
"density_atomic": 0.10117473438817982,
"volume": 39.53556215579566,
"volume_molar": 5.952218008198263,
"formula_full": "Cr1 Cu1 O2",
"formula_reduced": "CrCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9443087125,
"spacegroup": 166
},
{
"id": "jvasp-101209",
"created_at": "2022-09-04T14:36:48.313493Z",
"updated_at": "2022-09-04T14:36:48.313520Z",
"structure_string": "Cr1 Cu1 P2 Se6\n1.0\n6.203995 -0.003477 0.882800\n-3.289466 5.260130 0.882800\n0.035816 0.064598 6.935609\nCr Cu P Se\n1 1 2 6\ndirect\n0.331542 0.668457 0.000000 Cr\n0.675528 0.324471 0.000000 Cu\n0.052676 0.054251 0.832467 P\n0.945747 0.947324 0.167533 P\n0.096613 0.437753 0.752552 Se\n0.418131 0.063805 0.750679 Se\n0.936194 0.581868 0.249322 Se\n0.562246 0.903387 0.247449 Se\n0.721051 0.739733 0.754283 Se\n0.260267 0.278949 0.245717 Se\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Cr",
"Cu",
"P",
"Se"
],
"chemical_system": "Cr-Cu-P-Se",
"density": 4.794651693011439,
"density_atomic": 0.04433640548323058,
"volume": 225.54828004228517,
"volume_molar": 13.582834905905402,
"formula_full": "Cr1 Cu1 P2 Se6",
"formula_reduced": "CrCu(PSe3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.214899905,
"spacegroup": 5
},
{
"id": "jvasp-34470",
"created_at": "2022-09-04T14:36:50.425019Z",
"updated_at": "2022-09-04T14:36:50.425049Z",
"structure_string": "Cr1 Cu1 S2\n1.0\n3.308597 0.094404 5.887664\n1.613726 2.889916 5.887664\n0.155710 0.094404 6.751825\nCr Cu S\n1 1 2\ndirect\n0.857007 0.857003 0.857002 Cr\n0.006711 0.006711 0.006711 Cu\n0.266057 0.266056 0.266056 S\n0.120229 0.120228 0.120228 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-S",
"density": 4.970507419308793,
"density_atomic": 0.06663938438532445,
"volume": 60.02456410568063,
"volume_molar": 9.036909352551307,
"formula_full": "Cr1 Cu1 S2",
"formula_reduced": "CrCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9343544625,
"spacegroup": 160
},
{
"id": "jvasp-80729",
"created_at": "2022-09-04T14:37:17.027038Z",
"updated_at": "2022-09-04T14:37:17.027058Z",
"structure_string": "Cr1 Cu1 S2\n1.0\n3.349940 -0.022136 5.536618\n1.527796 2.981346 5.536618\n-0.036487 -0.022136 6.471083\nCr Cu S\n1 1 2\ndirect\n0.000786 0.000786 0.000786 Cr\n0.853765 0.853763 0.853765 Cu\n0.255918 0.255917 0.255918 S\n0.734131 0.734130 0.734132 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-S",
"density": 4.542672525278029,
"density_atomic": 0.06090341991497357,
"volume": 65.6777567759634,
"volume_molar": 9.888017402647385,
"formula_full": "Cr1 Cu1 S2",
"formula_reduced": "CrCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8923369625,
"spacegroup": 160
},
{
"id": "jvasp-8103",
"created_at": "2022-09-04T14:37:04.492910Z",
"updated_at": "2022-09-04T14:37:04.492935Z",
"structure_string": "Cr1 Cu1 S2\n1.0\n3.348818 -0.022922 5.537369\n1.526785 2.980610 5.537369\n-0.037785 -0.022922 6.471136\nCr Cu S\n1 1 2\ndirect\n0.999443 0.999441 0.999437 Cr\n0.146460 0.146460 0.146460 Cu\n0.744310 0.744308 0.744306 S\n0.266093 0.266093 0.266092 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-S",
"density": 4.542659857280455,
"density_atomic": 0.060903250075661726,
"volume": 65.6779399298181,
"volume_molar": 9.888044977104727,
"formula_full": "Cr1 Cu1 S2",
"formula_reduced": "CrCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8923594625,
"spacegroup": 160
},
{
"id": "jvasp-79799",
"created_at": "2022-09-04T14:37:14.249295Z",
"updated_at": "2022-09-04T14:37:14.249332Z",
"structure_string": "Cr1 Cu1 Se2\n1.0\n-1.866794 -3.233382 -0.000000\n1.866794 -3.233382 -0.000000\n-0.000000 -2.155588 6.387452\nCr Cu Se\n1 1 2\ndirect\n0.000665 0.000665 0.998005 Cr\n0.856990 0.856990 0.429029 Cu\n0.734919 0.734919 0.795243 Se\n0.255426 0.255426 0.233722 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"Se"
],
"chemical_system": "Cr-Cu-Se",
"density": 5.888913621570408,
"density_atomic": 0.05187390393745083,
"volume": 77.11006298703045,
"volume_molar": 11.609191333009084,
"formula_full": "Cr1 Cu1 Se2",
"formula_reduced": "CrCuSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6960236458333338,
"spacegroup": 160
},
{
"id": "jvasp-14934",
"created_at": "2022-09-04T14:36:22.334542Z",
"updated_at": "2022-09-04T14:36:22.334566Z",
"structure_string": "Cr1 Cu1 Se2\n1.0\n3.604103 0.065647 6.140540\n1.719078 3.168382 6.140540\n0.108055 0.065647 7.119278\nCr Cu Se\n1 1 2\ndirect\n0.739773 0.739775 0.739775 Cr\n0.257912 0.257913 0.257913 Cu\n0.989306 0.989309 0.989309 Se\n0.143005 0.143005 0.143005 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Cu",
"Se"
],
"chemical_system": "Cr-Cu-Se",
"density": 5.846137857735432,
"density_atomic": 0.051497103392117834,
"volume": 77.67427168752644,
"volume_molar": 11.694134938319175,
"formula_full": "Cr1 Cu1 Se2",
"formula_reduced": "CrCuSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.743693645833334,
"spacegroup": 160
},
{
"id": "jvasp-29393",
"created_at": "2022-09-04T14:38:00.220967Z",
"updated_at": "2022-09-04T14:38:00.220996Z",
"structure_string": "Cr2 F4\n1.0\n2.576889 0.000000 -0.225226\n0.000000 5.051980 0.000000\n0.418754 0.000000 4.824411\nCr F\n2 4\ndirect\n0.499999 0.500000 0.499999 Cr\n0.000000 0.000000 0.000000 Cr\n0.500196 0.823832 0.260650 F\n-0.000197 0.323832 0.239350 F\n0.000195 0.676168 0.760650 F\n0.499803 0.176168 0.739349 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"F"
],
"chemical_system": "Cr-F",
"density": 4.722842120219439,
"density_atomic": 0.09481287309011875,
"volume": 63.28254597133721,
"volume_molar": 6.351606658176061,
"formula_full": "Cr2 F4",
"formula_reduced": "CrF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7075626550000003,
"spacegroup": 58
}
]
}