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=4560",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=4558",
"results": [
{
"id": "jvasp-93689",
"created_at": "2022-09-04T14:35:58.487988Z",
"updated_at": "2022-09-04T14:35:58.488024Z",
"structure_string": "Tb2 Ni4\n1.0\n-3.581892 -3.581892 0.000000\n-3.581892 0.000000 -3.581892\n-0.000000 -3.581892 -3.581892\nTb Ni\n2 4\ndirect\n0.749999 0.749999 0.749999 Tb\n0.000000 0.000000 0.000000 Tb\n0.874999 0.375000 0.375000 Ni\n0.375000 0.874999 0.375000 Ni\n0.375000 0.375000 0.874999 Ni\n0.375000 0.375000 0.375000 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Ni"
],
"chemical_system": "Ni-Tb",
"density": 9.984161987261842,
"density_atomic": 0.06528054833496509,
"volume": 91.91099267752816,
"volume_molar": 9.225015588256731,
"formula_full": "Tb2 Ni4",
"formula_reduced": "TbNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8736077333333334,
"spacegroup": 227
},
{
"id": "jvasp-93775",
"created_at": "2022-09-04T14:36:00.021728Z",
"updated_at": "2022-09-04T14:36:00.021737Z",
"structure_string": "Mg2 In4\n1.0\n-4.345211 -4.345211 0.000000\n-4.345211 -0.000000 -4.345211\n0.000000 -4.345211 -4.345211\nMg In\n2 4\ndirect\n0.625000 0.625000 0.625000 Mg\n0.375000 0.375000 0.375000 Mg\n0.000000 0.000000 0.500000 In\n0.000000 0.500000 0.000000 In\n0.500000 0.000000 0.000000 In\n0.000000 0.000000 0.000000 In\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"In"
],
"chemical_system": "In-Mg",
"density": 5.139836593582617,
"density_atomic": 0.036566942077864616,
"volume": 164.08262925633127,
"volume_molar": 16.468811494208683,
"formula_full": "Mg2 In4",
"formula_reduced": "MgIn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1825233333333333,
"spacegroup": 227
},
{
"id": "jvasp-15011",
"created_at": "2022-09-04T14:35:58.940405Z",
"updated_at": "2022-09-04T14:35:58.940433Z",
"structure_string": "Ta2 Be4\n1.0\n3.992377 0.000000 2.305000\n1.330792 3.764049 2.305000\n0.000000 -0.000000 4.610000\nTa Be\n2 4\ndirect\n0.875000 0.875000 0.875000 Ta\n0.125000 0.125000 0.125000 Ta\n0.500000 0.500000 0.500000 Be\n0.500000 0.500000 -0.000000 Be\n-0.000000 0.500000 0.500000 Be\n0.500000 -0.000000 0.500000 Be\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Be"
],
"chemical_system": "Be-Ta",
"density": 9.538582763665714,
"density_atomic": 0.08660909720687833,
"volume": 69.27678723712053,
"volume_molar": 6.953242735708522,
"formula_full": "Ta2 Be4",
"formula_reduced": "TaBe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.0175738,
"spacegroup": 227
},
{
"id": "jvasp-14635",
"created_at": "2022-09-04T14:35:59.465349Z",
"updated_at": "2022-09-04T14:35:59.465375Z",
"structure_string": "Tb2 Ni4\n1.0\n4.389020 -0.000000 2.534002\n1.463006 4.138008 2.534002\n0.000000 0.000000 5.068003\nTb Ni\n2 4\ndirect\n0.875001 0.875001 0.874998 Tb\n0.125000 0.125000 0.125000 Tb\n0.500000 0.000000 0.499999 Ni\n0.000000 0.500000 0.499999 Ni\n0.500000 0.500000 0.499999 Ni\n0.500000 0.500000 -0.000001 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Ni"
],
"chemical_system": "Ni-Tb",
"density": 9.969728375883422,
"density_atomic": 0.0651861754605627,
"volume": 92.04405623750651,
"volume_molar": 9.238371046393668,
"formula_full": "Tb2 Ni4",
"formula_reduced": "TbNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8736410666666669,
"spacegroup": 227
},
{
"id": "jvasp-93837",
"created_at": "2022-09-04T14:35:59.522392Z",
"updated_at": "2022-09-04T14:35:59.522423Z",
"structure_string": "Y2 Cu4\n1.0\n-3.722247 -3.722247 0.000000\n-3.722247 -0.000000 -3.722247\n0.000000 -3.722247 -3.722247\nY Cu\n2 4\ndirect\n0.125000 0.125000 0.125000 Y\n0.875001 0.875001 0.875001 Y\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Cu"
],
"chemical_system": "Cu-Y",
"density": 6.954773010282375,
"density_atomic": 0.058170887399448375,
"volume": 103.14437802537111,
"volume_molar": 10.352499384523927,
"formula_full": "Y2 Cu4",
"formula_reduced": "YCu2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5461954499999999,
"spacegroup": 227
},
{
"id": "jvasp-19869",
"created_at": "2022-09-04T14:35:59.655241Z",
"updated_at": "2022-09-04T14:35:59.655267Z",
"structure_string": "Pu2 Co4\n1.0\n4.172395 0.000000 2.408933\n1.390798 3.933772 2.408933\n0.000000 -0.000000 4.817867\nPu Co\n2 4\ndirect\n0.875000 0.875000 0.875000 Pu\n0.125000 0.125000 0.125000 Pu\n0.500000 0.500000 0.500000 Co\n0.500000 0.500000 -0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.499999 -0.000000 0.500000 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pu",
"Co"
],
"chemical_system": "Co-Pu",
"density": 15.197702300012502,
"density_atomic": 0.07587554830185747,
"volume": 79.07685854380992,
"volume_molar": 7.936866216823865,
"formula_full": "Pu2 Co4",
"formula_reduced": "PuCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.310043933333333,
"spacegroup": 227
},
{
"id": "jvasp-93333",
"created_at": "2022-09-04T14:35:59.856788Z",
"updated_at": "2022-09-04T14:35:59.856819Z",
"structure_string": "Zr2 Co4\n1.0\n-3.442746 -3.442746 -0.000000\n-3.442746 -0.000000 -3.442746\n-0.000000 -3.442746 -3.442746\nZr Co\n2 4\ndirect\n0.125000 0.125000 0.125000 Zr\n0.875001 0.875001 0.875001 Zr\n0.500001 0.500001 0.000000 Co\n0.500001 0.000000 0.500001 Co\n0.000000 0.500001 0.500001 Co\n0.500001 0.500001 0.500001 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Co"
],
"chemical_system": "Co-Zr",
"density": 8.508798185249761,
"density_atomic": 0.07352013699106086,
"volume": 81.61029407126276,
"volume_molar": 8.191144639368963,
"formula_full": "Zr2 Co4",
"formula_reduced": "ZrCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.0975821000000003,
"spacegroup": 227
},
{
"id": "jvasp-85863",
"created_at": "2022-09-04T14:36:00.484680Z",
"updated_at": "2022-09-04T14:36:00.484705Z",
"structure_string": "Eu2 Pd4\n1.0\n4.728291 0.000000 2.729880\n1.576096 4.457875 2.729880\n0.000000 0.000000 5.459760\nEu Pd\n2 4\ndirect\n0.125000 0.125000 0.125000 Eu\n0.875000 0.875001 0.874999 Eu\n0.500000 -0.000000 0.500000 Pd\n0.000000 0.500001 0.500000 Pd\n0.500000 0.500001 0.500000 Pd\n0.500000 0.500001 -0.000000 Pd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Eu",
"Pd"
],
"chemical_system": "Eu-Pd",
"density": 10.527689042491636,
"density_atomic": 0.05213694913978767,
"volume": 115.08153236801449,
"volume_molar": 11.550619779944657,
"formula_full": "Eu2 Pd4",
"formula_reduced": "EuPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1591238,
"spacegroup": 227
},
{
"id": "jvasp-19844",
"created_at": "2022-09-04T14:36:00.227697Z",
"updated_at": "2022-09-04T14:36:00.227729Z",
"structure_string": "Sc2 Al4\n1.0\n4.649008 -0.000000 2.684105\n1.549669 4.383126 2.684105\n-0.000000 -0.000000 5.368211\nSc Al\n2 4\ndirect\n0.875000 0.875001 0.875001 Sc\n0.125000 0.125000 0.125000 Sc\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.000001 Al\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sc",
"Al"
],
"chemical_system": "Al-Sc",
"density": 3.003204710988971,
"density_atomic": 0.05485010002585249,
"volume": 109.38904390642898,
"volume_molar": 10.979270333438928,
"formula_full": "Sc2 Al4",
"formula_reduced": "ScAl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.6021069500000005,
"spacegroup": 227
},
{
"id": "jvasp-98420",
"created_at": "2022-09-04T14:36:00.366778Z",
"updated_at": "2022-09-04T14:36:00.366812Z",
"structure_string": "Ti12 Zn12 N4\n1.0\n5.735430 5.735402 0.000089\n0.000065 5.735426 5.735352\n5.735457 0.000061 5.735356\nTi Zn N\n12 12 4\ndirect\n0.570880 0.929120 0.929120 Ti\n0.320891 0.679109 0.320892 Ti\n0.320891 0.320890 0.679109 Ti\n0.320882 0.679118 0.679118 Ti\n0.679105 0.679106 0.320895 Ti\n0.679117 0.320882 0.320884 Ti\n0.679104 0.320895 0.679105 Ti\n0.929115 0.929114 0.570885 Ti\n0.929122 0.570881 0.570879 Ti\n0.570892 0.929110 0.570891 Ti\n0.570889 0.570889 0.929112 Ti\n0.929107 0.570894 0.929107 Ti\n0.914610 0.914610 0.914610 Zn\n0.125004 0.124993 0.125004 Zn\n0.125007 0.625000 0.125001 Zn\n0.125005 0.124997 0.625001 Zn\n0.625001 0.125000 0.125003 Zn\n0.914615 0.256169 0.914610 Zn\n0.335382 0.335388 0.993837 Zn\n0.256160 0.914618 0.914612 Zn\n0.335385 0.335385 0.335389 Zn\n0.335384 0.993842 0.335386 Zn\n0.993837 0.335388 0.335385 Zn\n0.914612 0.914612 0.256165 Zn\n0.625003 0.124995 0.625002 N\n0.125001 0.625002 0.624997 N\n0.624997 0.625001 0.125000 N\n0.625001 0.625002 0.625004 N\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"N"
],
"chemical_system": "N-Ti-Zn",
"density": 6.228674669377208,
"density_atomic": 0.07420687946699135,
"volume": 377.3235069459421,
"volume_molar": 8.115340253161788,
"formula_full": "Ti12 Zn12 N4",
"formula_reduced": "Ti3Zn3N",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.8310884928571425,
"spacegroup": 227
},
{
"id": "jvasp-15044",
"created_at": "2022-09-04T14:36:01.915665Z",
"updated_at": "2022-09-04T14:36:01.915691Z",
"structure_string": "Ti2 Be4\n1.0\n3.933225 -0.000000 2.270848\n1.311075 3.708280 2.270848\n0.000000 0.000000 4.541697\nTi Be\n2 4\ndirect\n0.875002 0.875000 0.875000 Ti\n0.125000 0.125000 0.125000 Ti\n0.500001 0.500000 0.500000 Be\n0.500001 0.500000 -0.000000 Be\n0.000001 0.500000 0.500000 Be\n0.500001 -0.000000 0.500000 Be\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Be"
],
"chemical_system": "Be-Ti",
"density": 3.303452940168888,
"density_atomic": 0.09057571766130595,
"volume": 66.2429197904463,
"volume_molar": 6.648736455524287,
"formula_full": "Ti2 Be4",
"formula_reduced": "TiBe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1597001777777773,
"spacegroup": 227
},
{
"id": "jvasp-50414",
"created_at": "2022-09-04T14:36:01.987096Z",
"updated_at": "2022-09-04T14:36:01.987128Z",
"structure_string": "Na2 Sn4 O8\n1.0\n0.000000 6.659933 -0.000000\n3.329967 -3.329967 4.709378\n6.659933 0.000000 0.000000\nNa Sn O\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Na\n0.750000 0.500000 0.750000 Na\n0.375000 0.250000 0.375000 Sn\n0.875000 0.250000 0.375000 Sn\n0.375000 0.750000 0.375000 Sn\n0.375000 0.750000 0.875000 Sn\n0.143309 0.286617 0.143302 O\n0.606691 0.213383 0.179919 O\n0.570080 0.713383 0.143309 O\n0.143301 0.713383 0.143309 O\n0.606691 0.213383 0.606698 O\n0.143309 0.286617 0.570081 O\n0.606698 0.786618 0.606691 O\n0.179919 0.786618 0.606691 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Sn",
"O"
],
"chemical_system": "Na-O-Sn",
"density": 5.157824174797487,
"density_atomic": 0.06702313912579554,
"volume": 208.88308400063806,
"volume_molar": 8.985166673105331,
"formula_full": "Na2 Sn4 O8",
"formula_reduced": "Na(SnO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.3538552,
"spacegroup": 227
}
]
}