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=-spacegroup&page=3498",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3496",
"results": [
{
"id": "jvasp-86447",
"created_at": "2022-09-04T14:35:51.788168Z",
"updated_at": "2022-09-04T14:35:51.788179Z",
"structure_string": "V2 Cr4 C4\n1.0\n2.847629 -0.000000 0.000000\n-1.423815 4.592533 -0.000000\n0.000000 -0.000000 7.101161\nV Cr C\n2 4 4\ndirect\n0.404364 0.808725 0.750000 V\n0.595638 0.191274 0.250000 V\n0.140546 0.281092 0.573513 Cr\n0.859456 0.718907 0.426487 Cr\n0.859456 0.718907 0.073513 Cr\n0.140546 0.281092 0.926487 Cr\n0.249553 0.499104 0.250000 C\n0.750449 0.500895 0.750000 C\n0.500000 0.000000 0.500000 C\n0.500000 0.000000 0.000000 C\n",
"nsites": 10,
"nelements": 3,
"elements": [
"V",
"Cr",
"C"
],
"chemical_system": "C-Cr-V",
"density": 6.399677969207228,
"density_atomic": 0.10767997548702271,
"volume": 92.8677774560338,
"volume_molar": 5.592628279085903,
"formula_full": "V2 Cr4 C4",
"formula_reduced": "V(CrC)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.491863800000001,
"spacegroup": 63
},
{
"id": "jvasp-85340",
"created_at": "2022-09-04T14:35:51.805413Z",
"updated_at": "2022-09-04T14:35:51.805438Z",
"structure_string": "K2 U2 Cu2 Se6\n1.0\n4.100152 0.000000 -0.000000\n-2.050077 7.180552 -0.000000\n0.000000 0.000000 10.658001\nK U Cu Se\n2 2 2 6\ndirect\n0.746465 0.492933 0.750000 K\n0.253533 0.507067 0.250000 K\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 U\n0.533842 0.067685 0.250000 Cu\n0.466157 0.932314 0.750000 Cu\n0.932224 0.864450 0.250000 Se\n0.369876 0.739752 0.939754 Se\n0.630123 0.260248 0.060246 Se\n0.369876 0.739752 0.560246 Se\n0.630123 0.260248 0.439754 Se\n0.067774 0.135550 0.750000 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"U",
"Cu",
"Se"
],
"chemical_system": "Cu-K-Se-U",
"density": 6.112762884619655,
"density_atomic": 0.03824262550950546,
"volume": 313.78598723608343,
"volume_molar": 15.747194863760482,
"formula_full": "K2 U2 Cu2 Se6",
"formula_reduced": "KUCuSe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.439662425,
"spacegroup": 63
},
{
"id": "jvasp-28369",
"created_at": "2022-09-04T14:35:52.010636Z",
"updated_at": "2022-09-04T14:35:52.010661Z",
"structure_string": "Pb2 S2\n1.0\n-4.157335 0.000000 0.000000\n0.000000 0.000000 -4.305497\n-2.078668 -5.919289 -0.000000\nPb S\n2 2\ndirect\n0.128724 0.750001 0.742553 Pb\n0.871278 0.250000 0.257447 Pb\n0.358258 0.750001 0.283487 S\n0.641744 0.250000 0.716513 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 7.49981257876889,
"density_atomic": 0.037753057938748155,
"volume": 105.95168228464397,
"volume_molar": 15.951398611923109,
"formula_full": "Pb2 S2",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4173904099999999,
"spacegroup": 63
},
{
"id": "jvasp-22559",
"created_at": "2022-09-04T14:35:52.379033Z",
"updated_at": "2022-09-04T14:35:52.379052Z",
"structure_string": "Mg2 V2 O6\n1.0\n4.746679 0.000000 -2.452762\n0.000000 5.204861 0.000000\n-0.052065 0.000000 5.718602\nMg V O\n2 2 6\ndirect\n0.575961 0.012785 0.151922 Mg\n0.424038 0.512785 0.848077 Mg\n0.933738 0.012802 0.867476 V\n0.066261 0.512802 0.132524 V\n0.240987 0.262793 0.000016 O\n0.759012 0.762793 0.999984 O\n0.759029 0.262793 0.000016 O\n0.240970 0.762793 0.999984 O\n0.768374 0.012828 0.536748 O\n0.231625 0.512828 0.463252 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 2.9107604957737214,
"density_atomic": 0.07111465819728714,
"volume": 140.61798584840105,
"volume_molar": 8.468213041667592,
"formula_full": "Mg2 V2 O6",
"formula_reduced": "MgVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7506547500000005,
"spacegroup": 63
},
{
"id": "jvasp-86640",
"created_at": "2022-09-04T14:35:52.736735Z",
"updated_at": "2022-09-04T14:35:52.736749Z",
"structure_string": "Ba2 Al4 Si4\n1.0\n4.366459 0.000000 0.000000\n-2.183230 5.431844 0.000000\n0.000000 -0.000000 10.294009\nBa Al Si\n2 4 4\ndirect\n0.086615 0.173231 0.750000 Ba\n0.913384 0.826769 0.250000 Ba\n0.379770 0.759539 0.965352 Al\n0.620230 0.240460 0.465352 Al\n0.620230 0.240460 0.034648 Al\n0.379770 0.759539 0.534648 Al\n0.199953 0.399906 0.367984 Si\n0.800047 0.600094 0.867984 Si\n0.199953 0.399906 0.132016 Si\n0.800047 0.600094 0.632016 Si\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Si"
],
"chemical_system": "Al-Ba-Si",
"density": 3.3660826340932863,
"density_atomic": 0.04095800371652666,
"volume": 244.15252435667352,
"volume_molar": 14.703208685852166,
"formula_full": "Ba2 Al4 Si4",
"formula_reduced": "Ba(AlSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.936663754,
"spacegroup": 63
},
{
"id": "jvasp-94341",
"created_at": "2022-09-04T14:35:52.850521Z",
"updated_at": "2022-09-04T14:35:52.850549Z",
"structure_string": "Dy2 Sn2 Ge2\n1.0\n0.000000 -0.000000 -4.071763\n-4.275186 0.000000 -0.000000\n2.137592 8.192027 -0.000000\nDy Sn Ge\n2 2 2\ndirect\n0.749999 0.094640 0.189279 Dy\n0.250000 0.905362 0.810721 Dy\n0.749999 0.744582 0.489161 Sn\n0.250000 0.255420 0.510839 Sn\n0.749999 0.446533 0.893066 Ge\n0.250000 0.553468 0.106935 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Sn",
"Ge"
],
"chemical_system": "Dy-Ge-Sn",
"density": 8.240800720749222,
"density_atomic": 0.04207482995558406,
"volume": 142.6030718682369,
"volume_molar": 14.312929526648645,
"formula_full": "Dy2 Sn2 Ge2",
"formula_reduced": "DySnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5640613833333332,
"spacegroup": 63
},
{
"id": "jvasp-91280",
"created_at": "2022-09-04T14:35:52.937346Z",
"updated_at": "2022-09-04T14:35:52.937375Z",
"structure_string": "Sr2 In8 Pd2\n1.0\n4.466976 0.000000 -1.188737\n0.000000 7.580403 0.000000\n-0.006028 -0.000000 8.964607\nSr In Pd\n2 8 2\ndirect\n0.875295 0.250000 0.750588 Sr\n0.124706 0.750000 0.249412 Sr\n0.684135 0.049429 0.368269 In\n0.315866 0.950570 0.631731 In\n0.315866 0.549429 0.631731 In\n0.684135 0.450571 0.368269 In\n0.067891 0.250000 0.135781 In\n0.932110 0.750000 0.864219 In\n0.500001 0.000000 -0.000000 In\n0.500001 0.500000 -0.000000 In\n0.224385 0.250000 0.448769 Pd\n0.775616 0.750000 0.551231 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sr",
"In",
"Pd"
],
"chemical_system": "In-Pd-Sr",
"density": 7.148917415536407,
"density_atomic": 0.03953864644107572,
"volume": 303.5005261974142,
"volume_molar": 15.231024079124133,
"formula_full": "Sr2 In8 Pd2",
"formula_reduced": "SrIn4Pd",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0019883333333332,
"spacegroup": 63
},
{
"id": "jvasp-96918",
"created_at": "2022-09-04T14:35:53.229873Z",
"updated_at": "2022-09-04T14:35:53.229896Z",
"structure_string": "Ga12 Ir6\n1.0\n3.914350 -0.000000 0.000000\n-1.957175 6.583305 -0.000000\n0.000000 -0.000000 11.027391\nGa Ir\n12 6\ndirect\n0.442114 0.884225 0.605396 Ga\n0.178447 0.356893 0.018731 Ga\n0.821554 0.643106 0.981269 Ga\n0.958305 0.916608 0.250000 Ga\n0.765820 0.531639 0.250000 Ga\n0.234181 0.468361 0.750000 Ga\n0.041696 0.083392 0.750000 Ga\n0.821554 0.643106 0.518731 Ga\n0.442114 0.884225 0.894604 Ga\n0.557887 0.115774 0.105396 Ga\n0.557887 0.115774 0.394604 Ga\n0.178447 0.356893 0.481269 Ga\n0.146655 0.293310 0.250000 Ir\n0.639962 0.279923 0.621971 Ir\n0.360039 0.720076 0.378029 Ir\n0.360039 0.720076 0.121971 Ir\n0.639962 0.279923 0.878028 Ir\n0.853346 0.706689 0.750000 Ir\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Ga",
"Ir"
],
"chemical_system": "Ga-Ir",
"density": 11.62842690951116,
"density_atomic": 0.06334263124676089,
"volume": 284.16880773200364,
"volume_molar": 9.50724755424168,
"formula_full": "Ga12 Ir6",
"formula_reduced": "Ga2Ir",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9700385833333334,
"spacegroup": 63
},
{
"id": "jvasp-90620",
"created_at": "2022-09-04T14:35:53.350243Z",
"updated_at": "2022-09-04T14:35:53.350271Z",
"structure_string": "Dy2 Ga4 Ni2\n1.0\n4.143233 -0.000000 0.000000\n-2.071617 5.014582 -0.000000\n-0.000000 0.000000 6.604363\nDy Ga Ni\n2 4 2\ndirect\n0.425656 0.851313 0.250000 Dy\n0.574342 0.148687 0.750000 Dy\n0.140978 0.281955 0.446567 Ga\n0.859020 0.718044 0.553433 Ga\n0.140978 0.281955 0.053433 Ga\n0.859020 0.718044 0.946567 Ga\n0.708492 0.416986 0.250000 Ni\n0.291506 0.583013 0.750000 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Dy",
"Ga",
"Ni"
],
"chemical_system": "Dy-Ga-Ni",
"density": 8.728653119379965,
"density_atomic": 0.05830220186511472,
"volume": 137.2160869414234,
"volume_molar": 10.32918237622062,
"formula_full": "Dy2 Ga4 Ni2",
"formula_reduced": "DyGa2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2281083875,
"spacegroup": 63
},
{
"id": "jvasp-85620",
"created_at": "2022-09-04T14:35:53.674645Z",
"updated_at": "2022-09-04T14:35:53.674672Z",
"structure_string": "Ce4 Zn12\n1.0\n4.575765 -0.000000 0.000000\n0.000000 6.497045 0.000000\n0.000000 0.000000 10.312586\nCe Zn\n4 12\ndirect\n0.750001 0.750001 0.649229 Ce\n0.250000 0.750001 0.149229 Ce\n0.250000 0.250000 0.350772 Ce\n0.750001 0.250000 0.850772 Ce\n0.250000 0.250000 0.049010 Zn\n0.250000 0.443784 0.631328 Zn\n0.750001 0.556217 0.368672 Zn\n0.750001 0.056217 0.131328 Zn\n0.250000 0.056217 0.631328 Zn\n0.250000 0.943784 0.868673 Zn\n0.750001 0.943784 0.368672 Zn\n0.750001 0.250000 0.549010 Zn\n0.750001 0.750001 0.950990 Zn\n0.750001 0.443784 0.131328 Zn\n0.250000 0.556217 0.868673 Zn\n0.250000 0.750001 0.450990 Zn\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ce",
"Zn"
],
"chemical_system": "Ce-Zn",
"density": 7.286925210757665,
"density_atomic": 0.052188259416060756,
"volume": 306.5823650573036,
"volume_molar": 11.539263480679924,
"formula_full": "Ce4 Zn12",
"formula_reduced": "CeZn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2736985500000002,
"spacegroup": 63
},
{
"id": "jvasp-16228",
"created_at": "2022-09-04T14:35:53.394210Z",
"updated_at": "2022-09-04T14:35:53.394248Z",
"structure_string": "V2 B2\n1.0\n2.969374 -0.000000 -0.000000\n0.000000 2.856215 -1.083753\n-0.000000 0.000127 4.305964\nV B\n2 2\ndirect\n0.250000 0.851796 0.703592 V\n0.749999 0.148203 0.296407 V\n0.250000 0.561587 0.123176 B\n0.749999 0.438412 0.876823 B\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"B"
],
"chemical_system": "B-V",
"density": 5.615683016424001,
"density_atomic": 0.10952895380797102,
"volume": 36.520023801312874,
"volume_molar": 5.498218097251409,
"formula_full": "V2 B2",
"formula_reduced": "VB",
"formula_anonymous": "AB",
"energy_above_hull": 2.536688391666667,
"spacegroup": 63
},
{
"id": "jvasp-63341",
"created_at": "2022-09-04T14:35:53.421333Z",
"updated_at": "2022-09-04T14:35:53.421359Z",
"structure_string": "Na4 Bi2 Au2\n1.0\n3.806344 -4.731135 0.000000\n3.806344 4.731135 0.000000\n-0.000000 0.000000 5.969655\nNa Bi Au\n4 2 2\ndirect\n0.496380 0.136916 0.250000 Na\n0.503619 0.863083 0.750001 Na\n0.136916 0.496380 0.250000 Na\n0.863083 0.503619 0.750001 Na\n0.685975 0.685975 0.250000 Bi\n0.314024 0.314024 0.750001 Bi\n0.000000 0.000000 0.000000 Au\n0.000000 0.000000 0.500000 Au\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Na",
"density": 6.9806249326636305,
"density_atomic": 0.037208090473615105,
"volume": 215.0070024602025,
"volume_molar": 16.185030415012573,
"formula_full": "Na4 Bi2 Au2",
"formula_reduced": "Na2BiAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.499999999999337e-05,
"spacegroup": 63
}
]
}