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=384",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=382",
"results": [
{
"id": "jvasp-112810",
"created_at": "2022-09-04T14:38:43.907134Z",
"updated_at": "2022-09-04T14:38:43.907160Z",
"structure_string": "Li3 Fe3 Ni1 O8\n1.0\n4.912428 0.009279 2.815901\n1.619879 4.637675 2.815901\n-0.029151 -0.020737 5.756884\nLi Fe Ni O\n3 3 1 8\ndirect\n0.500000 0.000000 -0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 -0.000000 Li\n0.500000 -0.000000 0.499999 Fe\n0.000000 0.499999 0.500000 Fe\n0.500001 0.499999 0.500000 Fe\n0.000000 -0.000000 0.500000 Ni\n0.753675 0.272067 0.714018 O\n0.262173 0.262172 0.717602 O\n0.754200 0.754198 0.723148 O\n0.272069 0.753673 0.714018 O\n0.727933 0.246326 0.285981 O\n0.245801 0.245801 0.276851 O\n0.737828 0.737827 0.282397 O\n0.246326 0.727931 0.285981 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ni",
"O"
],
"chemical_system": "Fe-Li-Ni-O",
"density": 4.730914943621047,
"density_atomic": 0.1139467831087618,
"volume": 131.64039905964307,
"volume_molar": 5.2850467522649485,
"formula_full": "Li3 Fe3 Ni1 O8",
"formula_reduced": "Li3Fe3NiO8",
"formula_anonymous": "AB3C3D8",
"energy_above_hull": 2.5981797933333337,
"spacegroup": 12
},
{
"id": "jvasp-119215",
"created_at": "2022-09-04T14:38:36.566015Z",
"updated_at": "2022-09-04T14:38:36.566039Z",
"structure_string": "Ba2 Pr2 Co4 O11\n1.0\n3.839597 -0.000000 0.000000\n0.000000 7.610784 0.000000\n-0.000000 -0.000000 7.977816\nBa Pr Co O\n2 2 4 11\ndirect\n0.500000 0.000000 0.247953 Ba\n0.500000 0.000000 0.752048 Ba\n0.500000 0.500000 0.267702 Pr\n0.500000 0.500000 0.732298 Pr\n-0.000000 0.748281 -0.000000 Co\n-0.000000 0.251718 -0.000000 Co\n-0.000000 0.752467 0.500000 Co\n-0.000000 0.247532 0.500000 Co\n0.500000 0.265792 0.500000 O\n0.500000 0.734207 0.500000 O\n0.000000 0.000000 0.000000 O\n-0.000000 0.286536 0.235495 O\n0.500000 0.302548 -0.000000 O\n-0.000000 0.713463 0.764505 O\n-0.000000 0.713463 0.235495 O\n0.000000 0.000000 0.500000 O\n0.500000 0.697451 -0.000000 O\n-0.000000 0.286536 0.764505 O\n-0.000000 0.500000 0.500000 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Ba",
"Pr",
"Co",
"O"
],
"chemical_system": "Ba-Co-O-Pr",
"density": 6.896251518047812,
"density_atomic": 0.08149942510324376,
"volume": 233.13047884608673,
"volume_molar": 7.389181889775457,
"formula_full": "Ba2 Pr2 Co4 O11",
"formula_reduced": "Ba2Pr2Co4O11",
"formula_anonymous": "A2B2C4D11",
"energy_above_hull": 2.7078507231578945,
"spacegroup": 47
},
{
"id": "jvasp-116943",
"created_at": "2022-09-04T14:38:47.339639Z",
"updated_at": "2022-09-04T14:38:47.339657Z",
"structure_string": "Ba4 In2 Sb2 Se10\n1.0\n9.860121 0.015834 0.000000\n-8.908040 4.227181 0.000000\n-0.000000 -0.000000 13.231190\nBa In Sb Se\n4 2 2 10\ndirect\n0.886520 0.113479 0.812071 Ba\n0.113479 0.886520 0.312071 Ba\n0.870489 0.129509 0.189510 Ba\n0.129509 0.870490 0.689510 Ba\n0.560275 0.439724 0.053480 In\n0.439724 0.560275 0.553480 In\n0.782316 0.217683 0.477580 Sb\n0.217683 0.782316 0.977580 Sb\n0.355595 0.644404 0.998434 Se\n0.644404 0.355595 0.498434 Se\n0.310246 0.689753 0.634002 Se\n0.689753 0.310245 0.134002 Se\n0.954723 0.045275 0.439700 Se\n0.716707 0.283292 0.834959 Se\n0.045276 0.954723 0.939700 Se\n0.496130 0.503869 0.225424 Se\n0.283292 0.716707 0.334959 Se\n0.503869 0.496130 0.725424 Se\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"In",
"Sb",
"Se"
],
"chemical_system": "Ba-In-Sb-Se",
"density": 5.437802530546256,
"density_atomic": 0.03252919438586655,
"volume": 553.3490865614775,
"volume_molar": 18.51303382605912,
"formula_full": "Ba4 In2 Sb2 Se10",
"formula_reduced": "Ba2InSbSe5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 0.856709427037037,
"spacegroup": 36
},
{
"id": "jvasp-110496",
"created_at": "2022-09-04T14:38:38.187318Z",
"updated_at": "2022-09-04T14:38:38.187339Z",
"structure_string": "Y2 P2 Os4 C2\n1.0\n5.914773 -0.009825 0.000000\n-4.667699 3.632800 -0.000000\n0.000000 -0.000000 7.066124\nY P Os C\n2 2 4 2\ndirect\n0.543181 0.456819 0.250000 Y\n0.456819 0.543182 0.750000 Y\n0.268386 0.731615 0.250000 P\n0.731614 0.268387 0.750000 P\n0.834687 0.165314 0.051969 Os\n0.165313 0.834687 0.948031 Os\n0.165313 0.834687 0.551968 Os\n0.834687 0.165314 0.448031 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Y",
"P",
"Os",
"C"
],
"chemical_system": "C-Os-P-Y",
"density": 11.230864284564808,
"density_atomic": 0.06600351753223757,
"volume": 151.50707680262312,
"volume_molar": 9.123969426415272,
"formula_full": "Y2 P2 Os4 C2",
"formula_reduced": "YPOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.977830190000001,
"spacegroup": 63
},
{
"id": "jvasp-111096",
"created_at": "2022-09-04T14:38:38.191080Z",
"updated_at": "2022-09-04T14:38:38.191103Z",
"structure_string": "Cd2 In1 Ag1 S4\n1.0\n7.091648 0.002711 3.491015\n5.873652 3.973875 3.491015\n-0.037354 -0.011457 7.218946\nCd In Ag S\n2 1 1 4\ndirect\n0.494739 0.494738 0.175433 Cd\n0.004407 0.004406 0.648309 Cd\n0.753155 0.753152 0.599658 In\n0.246886 0.246885 0.072776 Ag\n0.061099 0.061098 0.263274 S\n0.566816 0.566813 0.770498 S\n0.817878 0.817874 0.855153 S\n0.302822 0.302820 0.366897 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cd",
"In",
"Ag",
"S"
],
"chemical_system": "Ag-Cd-In-S",
"density": 4.689198076546875,
"density_atomic": 0.0392366384642227,
"volume": 203.8910649110441,
"volume_molar": 15.348258657507557,
"formula_full": "Cd2 In1 Ag1 S4",
"formula_reduced": "Cd2InAgS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.37071209125,
"spacegroup": 8
},
{
"id": "jvasp-119651",
"created_at": "2022-09-04T14:38:36.579903Z",
"updated_at": "2022-09-04T14:38:36.579929Z",
"structure_string": "Na4 Nd4 Pt2 O12\n1.0\n6.601287 0.014754 0.127778\n0.100635 6.600536 0.127778\n0.014834 0.014642 6.651399\nNa Nd Pt O\n4 4 2 12\ndirect\n0.242507 0.757493 0.500000 Na\n0.754361 0.245639 0.000000 Na\n0.895988 0.754420 0.144584 Na\n0.245579 0.104011 0.855417 Na\n0.611463 0.388536 0.500000 Nd\n0.756659 0.885847 0.647163 Nd\n0.376792 0.623208 0.000000 Nd\n0.114153 0.243340 0.352838 Nd\n0.506961 0.001431 0.243668 Pt\n0.998569 0.493039 0.756333 Pt\n0.073876 0.783638 0.809698 O\n0.449945 0.308095 0.187036 O\n0.574350 0.942342 0.945698 O\n0.797098 0.085366 0.316811 O\n0.057658 0.425649 0.054303 O\n0.216362 0.926124 0.190303 O\n0.914633 0.202901 0.683190 O\n0.554454 0.704090 0.323975 O\n0.431384 0.060611 0.535315 O\n0.295909 0.445546 0.676026 O\n0.691904 0.550054 0.812965 O\n0.939389 0.568616 0.464686 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Na",
"Nd",
"Pt",
"O"
],
"chemical_system": "Na-Nd-O-Pt",
"density": 7.169152645535517,
"density_atomic": 0.07591954471369576,
"volume": 289.78045222696437,
"volume_molar": 7.932266694578342,
"formula_full": "Na4 Nd4 Pt2 O12",
"formula_reduced": "Na2Nd2PtO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 1.8695112181818176,
"spacegroup": 5
},
{
"id": "jvasp-120616",
"created_at": "2022-09-04T14:38:47.861111Z",
"updated_at": "2022-09-04T14:38:47.861137Z",
"structure_string": "Li2 Yb2 W4 O16\n1.0\n5.965170 0.000000 0.000000\n-0.000000 4.519126 2.096212\n-0.000000 0.023245 10.989982\nYb Li W O\n2 2 4 16\ndirect\n0.667351 0.000001 0.750000 Yb\n0.332649 0.000000 0.250000 Yb\n0.274540 0.500001 0.750000 Li\n0.725460 0.500001 0.250000 Li\n0.179160 0.242368 0.510942 W\n0.820840 0.757634 0.489057 W\n0.179160 0.757634 0.989057 W\n0.820840 0.242368 0.010942 W\n0.107994 0.657947 0.402868 O\n0.892006 0.342055 0.597132 O\n0.909658 0.837631 0.108126 O\n0.090342 0.162371 0.891873 O\n0.909658 0.162371 0.391874 O\n0.090342 0.837631 0.608126 O\n0.643719 0.276312 0.135956 O\n0.375796 0.772122 0.110194 O\n0.643719 0.723689 0.364043 O\n0.356281 0.276313 0.635956 O\n0.892006 0.657948 0.902868 O\n0.624204 0.227880 0.889805 O\n0.375796 0.227880 0.389806 O\n0.624204 0.772122 0.610194 O\n0.356281 0.723690 0.864043 O\n0.107994 0.342054 0.097132 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Yb",
"Li",
"W",
"O"
],
"chemical_system": "Li-O-W-Yb",
"density": 7.581530710870839,
"density_atomic": 0.08108924947256635,
"volume": 295.97018292936036,
"volume_molar": 7.426558759848156,
"formula_full": "Li2 Yb2 W4 O16",
"formula_reduced": "LiYb(WO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.355906558333333,
"spacegroup": 13
},
{
"id": "jvasp-110901",
"created_at": "2022-09-04T14:38:37.478582Z",
"updated_at": "2022-09-04T14:38:37.478609Z",
"structure_string": "La2 Si2 Os4 C2\n1.0\n5.962674 0.000235 0.000000\n-4.590996 3.804764 0.000000\n0.000000 0.000000 7.231671\nLa Si Os C\n2 2 4 2\ndirect\n0.550492 0.449506 0.250000 La\n0.449505 0.550492 0.750000 La\n0.271018 0.728979 0.250000 Si\n0.728979 0.271019 0.750000 Si\n0.834107 0.165890 0.059194 Os\n0.165889 0.834108 0.940806 Os\n0.165889 0.834108 0.559194 Os\n0.834107 0.165890 0.440806 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Si",
"Os",
"C"
],
"chemical_system": "C-La-Os-Si",
"density": 11.324559770827188,
"density_atomic": 0.060949745680094994,
"volume": 164.06959353836658,
"volume_molar": 9.880501867240302,
"formula_full": "La2 Si2 Os4 C2",
"formula_reduced": "LaSiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.79678472,
"spacegroup": 63
},
{
"id": "jvasp-111114",
"created_at": "2022-09-04T14:38:38.213565Z",
"updated_at": "2022-09-04T14:38:38.213582Z",
"structure_string": "Ag2 Bi1 Sb1 Se4\n1.0\n5.322373 0.020124 -4.813091\n-1.035718 5.220666 -4.813091\n-0.016460 -0.020124 7.175878\nAg Bi Sb Se\n2 1 1 4\ndirect\n0.499999 0.500000 -0.000000 Ag\n0.250000 0.750001 0.500001 Ag\n0.749999 0.250000 0.500000 Bi\n0.000000 0.000000 0.000000 Sb\n0.497068 0.997069 0.500001 Se\n0.247196 0.247196 -0.000000 Se\n0.002931 0.502932 0.500001 Se\n0.752803 0.752804 -0.000000 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ag",
"Bi",
"Sb",
"Se"
],
"chemical_system": "Ag-Bi-Sb-Se",
"density": 7.213181838556533,
"density_atomic": 0.040299617378925755,
"volume": 198.51305099942493,
"volume_molar": 14.943419197694945,
"formula_full": "Ag2 Bi1 Sb1 Se4",
"formula_reduced": "Ag2BiSbSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.0700247983333333,
"spacegroup": 119
},
{
"id": "jvasp-60091",
"created_at": "2022-09-04T14:38:36.738383Z",
"updated_at": "2022-09-04T14:38:36.738408Z",
"structure_string": "Ca12 Si12 Ag8 O48\n1.0\n10.131343 -0.000000 -3.581971\n-5.065671 8.774001 -3.581971\n0.000000 0.000000 10.745912\nCa Si Ag O\n12 12 8 48\ndirect\n0.375000 0.750000 0.125000 Ca\n0.250000 0.375000 0.125000 Ca\n0.625000 0.875000 0.750000 Ca\n0.875000 0.625000 0.250000 Ca\n0.625000 0.250000 0.875000 Ca\n0.750000 0.625000 0.875000 Ca\n0.250000 0.875000 0.625000 Ca\n0.875000 0.750000 0.625000 Ca\n0.125000 0.375000 0.750000 Ca\n0.375000 0.125000 0.250000 Ca\n0.125000 0.250000 0.375000 Ca\n0.750000 0.125000 0.375000 Ca\n0.375000 0.625000 0.750000 Si\n0.250000 0.625000 0.375000 Si\n0.625000 0.750000 0.375000 Si\n0.875000 0.250000 0.125000 Si\n0.125000 0.875000 0.250000 Si\n0.750000 0.375000 0.625000 Si\n0.750000 0.875000 0.125000 Si\n0.125000 0.750000 0.875000 Si\n0.625000 0.375000 0.250000 Si\n0.375000 0.250000 0.625000 Si\n0.250000 0.125000 0.875000 Si\n0.875000 0.125000 0.750000 Si\n0.500000 0.500000 0.000000 Ag\n0.500000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Ag\n0.500000 -0.000000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n-0.000000 -0.000000 0.500000 Ag\n0.000000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Ag\n0.983880 0.703068 0.106691 O\n0.877189 0.393310 0.096378 O\n0.780811 0.403622 0.796931 O\n0.780811 0.877189 0.983880 O\n0.403622 0.796931 0.780811 O\n0.393309 0.796931 0.516120 O\n0.796931 0.780811 0.403622 O\n0.719188 0.703068 0.096378 O\n0.703068 0.106690 0.983880 O\n0.622810 0.719188 0.516120 O\n0.096378 0.877189 0.393310 O\n0.719188 0.516120 0.622810 O\n0.393309 0.096378 0.877189 O\n0.106690 0.983880 0.703068 O\n0.622810 0.403622 0.106691 O\n0.516120 0.393310 0.796931 O\n0.877189 0.983880 0.780811 O\n0.403622 0.106690 0.622810 O\n0.796931 0.516120 0.393310 O\n0.983880 0.780811 0.877189 O\n0.096378 0.719188 0.703068 O\n0.516120 0.622810 0.719188 O\n0.280811 0.296931 0.903622 O\n0.203068 0.219188 0.596378 O\n0.377189 0.280811 0.483880 O\n0.280811 0.483880 0.377190 O\n0.016120 0.296931 0.893309 O\n0.122810 0.606690 0.903622 O\n0.219188 0.596378 0.203069 O\n0.219188 0.122810 0.016120 O\n0.596378 0.203068 0.219188 O\n0.606690 0.203068 0.483880 O\n0.703068 0.096378 0.719188 O\n0.893309 0.377189 0.596378 O\n0.296931 0.903622 0.280812 O\n0.903622 0.280811 0.296931 O\n0.016120 0.219188 0.122810 O\n0.203068 0.483880 0.606690 O\n0.596378 0.893309 0.377190 O\n0.122810 0.016120 0.219188 O\n0.483880 0.606690 0.203069 O\n0.377189 0.596378 0.893309 O\n0.893309 0.016120 0.296931 O\n0.606690 0.903622 0.122811 O\n0.106690 0.622810 0.403622 O\n0.903622 0.122810 0.606690 O\n0.296931 0.893309 0.016120 O\n0.483880 0.377189 0.280812 O\n",
"nsites": 80,
"nelements": 4,
"elements": [
"Ca",
"Si",
"Ag",
"O"
],
"chemical_system": "Ag-Ca-O-Si",
"density": 4.257046665432843,
"density_atomic": 0.08374945873183971,
"volume": 955.2300541565859,
"volume_molar": 7.1906623053917285,
"formula_full": "Ca12 Si12 Ag8 O48",
"formula_reduced": "Ca3Si3(AgO6)2",
"formula_anonymous": "A2B3C3D12",
"energy_above_hull": 2.187651679,
"spacegroup": 230
},
{
"id": "jvasp-21388",
"created_at": "2022-09-04T14:38:32.597786Z",
"updated_at": "2022-09-04T14:38:32.597806Z",
"structure_string": "Sr2 Li2 Al2 F12\n1.0\n2.552496 -4.421051 -0.000000\n2.552496 4.421051 0.000000\n0.000000 0.000000 10.305641\nSr Li Al F\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.333334 0.666668 0.250000 Li\n0.666668 0.333334 0.750000 Li\n0.666668 0.333334 0.250000 Al\n0.333334 0.666668 0.750000 Al\n0.641554 0.027551 0.351809 F\n0.358448 0.385998 0.851809 F\n0.972451 0.614004 0.351809 F\n0.385997 0.027551 0.148191 F\n0.641554 0.614004 0.148191 F\n0.027551 0.385997 0.648191 F\n0.614004 0.641554 0.648191 F\n0.027551 0.641554 0.851809 F\n0.358448 0.972451 0.648191 F\n0.972451 0.358448 0.148191 F\n0.385998 0.358448 0.351809 F\n0.614004 0.972451 0.851809 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Sr",
"Li",
"Al",
"F"
],
"chemical_system": "Al-F-Li-Sr",
"density": 3.3630643612190325,
"density_atomic": 0.07738858479906334,
"volume": 232.59244301645197,
"volume_molar": 7.781691286429738,
"formula_full": "Sr2 Li2 Al2 F12",
"formula_reduced": "SrLiAlF6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 0.0,
"spacegroup": 163
},
{
"id": "jvasp-111315",
"created_at": "2022-09-04T14:38:47.987993Z",
"updated_at": "2022-09-04T14:38:47.988004Z",
"structure_string": "Ba2 Lu1 U1 O6\n1.0\n5.316068 0.000000 3.069233\n1.772023 5.012037 3.069233\n-0.000000 -0.000000 6.138467\nBa Lu U O\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 U\n0.751989 0.751990 0.248010 O\n0.248011 0.248011 0.751989 O\n0.751989 0.248011 0.751989 O\n0.248010 0.751990 0.248010 O\n0.248010 0.751990 0.751989 O\n0.751989 0.248011 0.248010 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Lu",
"U",
"O"
],
"chemical_system": "Ba-Lu-O-U",
"density": 7.956177600439137,
"density_atomic": 0.061141385886142055,
"volume": 163.55533743742862,
"volume_molar": 9.849532640974926,
"formula_full": "Ba2 Lu1 U1 O6",
"formula_reduced": "Ba2LuUO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.191490469,
"spacegroup": 225
}
]
}