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=elements&page=3862",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=3860",
"results": [
{
"id": "jvasp-14159",
"created_at": "2022-09-04T14:37:01.797167Z",
"updated_at": "2022-09-04T14:37:01.797187Z",
"structure_string": "Zr4 Al2 N2\n1.0\n1.631478 -2.825803 -0.000000\n1.631478 2.825803 -0.000000\n-0.000000 -0.000000 14.410740\nZr Al N\n4 2 2\ndirect\n0.666667 0.333334 0.911334 Zr\n0.333334 0.666667 0.411334 Zr\n0.333334 0.666667 0.088666 Zr\n0.666667 0.333334 0.588666 Zr\n0.666667 0.333334 0.250000 Al\n0.333334 0.666667 0.750000 Al\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 5.584616084325749,
"density_atomic": 0.06020750147374163,
"volume": 132.8738081497876,
"volume_molar": 10.002309699940701,
"formula_full": "Zr4 Al2 N2",
"formula_reduced": "Zr2AlN",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5610087625,
"spacegroup": 194
},
{
"id": "jvasp-116578",
"created_at": "2022-09-04T14:38:43.481147Z",
"updated_at": "2022-09-04T14:38:43.481172Z",
"structure_string": "Zr10 Al6 N2\n1.0\n8.232758 -0.000000 0.000000\n-4.116378 7.129778 0.000000\n-0.000000 -0.000000 5.644542\nZr Al N\n10 6 2\ndirect\n0.222927 0.000000 0.250000 Zr\n0.333333 0.666667 0.500000 Zr\n0.666667 0.333333 -0.000000 Zr\n0.333333 0.666667 -0.000000 Zr\n0.222927 0.222927 0.750000 Zr\n0.666667 0.333333 0.500000 Zr\n-0.000000 0.777073 0.750000 Zr\n-0.000000 0.222927 0.250000 Zr\n0.777073 0.000000 0.750000 Zr\n0.777073 0.777073 0.250000 Zr\n0.597642 0.000000 0.250000 Al\n0.402358 0.000000 0.750000 Al\n-0.000000 0.597642 0.250000 Al\n-0.000000 0.402358 0.750000 Al\n0.402358 0.402358 0.250000 Al\n0.597642 0.597642 0.750000 Al\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 5.523785847955422,
"density_atomic": 0.05432784009256405,
"volume": 331.3218410548166,
"volume_molar": 11.08481535385807,
"formula_full": "Zr10 Al6 N2",
"formula_reduced": "Zr5Al3N",
"formula_anonymous": "AB3C5",
"energy_above_hull": 4.0917671277777785,
"spacegroup": 193
},
{
"id": "jvasp-99903",
"created_at": "2022-09-04T14:36:21.189439Z",
"updated_at": "2022-09-04T14:36:21.189463Z",
"structure_string": "Zr3 Al1 N4\n1.0\n3.205349 0.000000 0.000000\n0.000000 3.205349 -0.000000\n0.000000 -0.000000 8.950817\nZr Al N\n3 1 4\ndirect\n0.500000 0.500000 0.751516 Zr\n0.000000 0.000000 0.500000 Zr\n0.500000 0.500000 0.248484 Zr\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.225665 N\n0.500000 0.500000 0.000000 N\n0.000000 0.000000 0.774336 N\n0.500000 0.500000 0.500000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 6.440431187834954,
"density_atomic": 0.08699146879555962,
"volume": 91.963040867846,
"volume_molar": 6.922679710297515,
"formula_full": "Zr3 Al1 N4",
"formula_reduced": "Zr3AlN4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 4.921912412499999,
"spacegroup": 123
},
{
"id": "jvasp-120305",
"created_at": "2022-09-04T14:38:52.795445Z",
"updated_at": "2022-09-04T14:38:52.795474Z",
"structure_string": "Zr1 Al1 N2\n1.0\n3.125898 0.000000 0.000000\n0.000000 3.125898 0.000000\n0.000000 0.000000 4.466473\nZr Al N\n1 1 2\ndirect\n0.500000 0.500000 0.502494 Zr\n0.000000 0.000000 0.002516 Al\n0.000000 0.000000 0.502505 N\n0.500000 0.500000 0.002486 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 5.563375918140052,
"density_atomic": 0.09165278646445241,
"volume": 43.642972072119186,
"volume_molar": 6.570603025076265,
"formula_full": "Zr1 Al1 N2",
"formula_reduced": "ZrAlN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.74067595,
"spacegroup": 123
},
{
"id": "jvasp-120304",
"created_at": "2022-09-04T14:38:53.703082Z",
"updated_at": "2022-09-04T14:38:53.703101Z",
"structure_string": "Zr1 Al1 N1\n1.0\n2.826291 1.338447 0.000000\n0.486877 6.269268 0.000000\n0.000000 0.000000 3.262968\nZr Al N\n1 1 1\ndirect\n-0.061511 0.411966 0.000000 Zr\n-0.022833 -0.126625 0.000000 Al\n0.302778 0.047968 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 3.9422828826084184,
"density_atomic": 0.0538701621598838,
"volume": 55.68945553006056,
"volume_molar": 11.178991334992837,
"formula_full": "Zr1 Al1 N1",
"formula_reduced": "ZrAlN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.1706235166666668,
"spacegroup": 25
},
{
"id": "jvasp-24635",
"created_at": "2022-09-04T14:37:13.034431Z",
"updated_at": "2022-09-04T14:37:13.034464Z",
"structure_string": "Zr6 Al2 N2\n1.0\n3.377005 0.000000 0.000000\n-1.688502 5.793799 0.000000\n-0.000000 -0.000000 9.010249\nZr Al N\n6 2 2\ndirect\n0.044730 0.089459 0.750000 Zr\n0.955273 0.910541 0.250000 Zr\n0.373250 0.746498 0.542816 Zr\n0.626753 0.253502 0.457184 Zr\n0.626753 0.253502 0.042816 Zr\n0.373250 0.746498 0.957184 Zr\n0.253490 0.506979 0.250000 Al\n0.746512 0.493021 0.750000 Al\n0.000000 0.000000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zr",
"Al",
"N"
],
"chemical_system": "Al-N-Zr",
"density": 5.927738541451406,
"density_atomic": 0.056724160726918445,
"volume": 176.29172246623477,
"volume_molar": 10.616535675145201,
"formula_full": "Zr6 Al2 N2",
"formula_reduced": "Zr3AlN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.0011119100000005,
"spacegroup": 63
},
{
"id": "jvasp-15291",
"created_at": "2022-09-04T14:36:51.636085Z",
"updated_at": "2022-09-04T14:36:51.636112Z",
"structure_string": "Zr1 Al1 Ni2\n1.0\n3.749651 0.000000 2.164862\n1.249883 3.535205 2.164862\n0.000000 -0.000000 4.329724\nZr Al Ni\n1 1 2\ndirect\n0.499999 0.500001 0.499999 Zr\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ni\n0.749999 0.750001 0.749999 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 6.816235665946571,
"density_atomic": 0.06969382942039018,
"volume": 57.39389029511023,
"volume_molar": 8.640852153028794,
"formula_full": "Zr1 Al1 Ni2",
"formula_reduced": "ZrAlNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.856360525,
"spacegroup": 225
},
{
"id": "jvasp-103393",
"created_at": "2022-09-04T14:36:35.126805Z",
"updated_at": "2022-09-04T14:36:35.126828Z",
"structure_string": "Zr2 Al3 Ni1\n1.0\n4.540647 -0.011384 2.412835\n1.445127 4.304558 2.412835\n-0.015873 -0.011384 5.141888\nZr Al Ni\n2 3 1\ndirect\n0.625337 0.625338 0.625335 Zr\n0.374664 0.374664 0.374662 Zr\n0.000000 0.500000 -0.000001 Al\n0.500000 0.000001 -0.000001 Al\n0.000000 0.000001 0.500000 Al\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 5.304044880723432,
"density_atomic": 0.05950280977106419,
"volume": 100.83557437177966,
"volume_molar": 10.120767041371762,
"formula_full": "Zr2 Al3 Ni1",
"formula_reduced": "Zr2Al3Ni",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.6262333000000004,
"spacegroup": 166
},
{
"id": "jvasp-120491",
"created_at": "2022-09-04T14:38:52.182600Z",
"updated_at": "2022-09-04T14:38:52.182625Z",
"structure_string": "Zr10 Al2 Ni8\n1.0\n7.165628 -0.000000 0.000000\n0.000000 7.165628 0.000000\n0.000000 -0.000000 6.622876\nZr Al Ni\n10 2 8\ndirect\n0.316658 0.816658 0.250000 Zr\n0.000000 0.000000 0.000000 Zr\n0.341311 0.841311 0.750000 Zr\n0.658690 0.158690 0.750000 Zr\n0.158690 0.341311 0.250000 Zr\n0.500000 0.500000 0.500000 Zr\n0.816658 0.683342 0.750000 Zr\n0.183342 0.316658 0.750000 Zr\n0.683342 0.183342 0.250000 Zr\n0.841311 0.658690 0.250000 Zr\n0.000000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.625528 0.874410 0.030525 Ni\n0.125590 0.625528 0.969476 Ni\n0.874410 0.374472 0.969476 Ni\n0.374410 0.125528 0.469475 Ni\n0.625590 0.874472 0.469475 Ni\n0.874472 0.374410 0.530525 Ni\n0.125528 0.625590 0.530525 Ni\n0.374472 0.125590 0.030525 Ni\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 7.010885364102888,
"density_atomic": 0.05881320616810947,
"volume": 340.05967882167056,
"volume_molar": 10.239436263322455,
"formula_full": "Zr10 Al2 Ni8",
"formula_reduced": "Zr5AlNi4",
"formula_anonymous": "AB4C5",
"energy_above_hull": 3.23392949,
"spacegroup": 118
},
{
"id": "jvasp-99896",
"created_at": "2022-09-04T14:36:14.296791Z",
"updated_at": "2022-09-04T14:36:14.296818Z",
"structure_string": "Zr1 Al1 Ni2\n1.0\n2.919756 0.000000 -0.000000\n-0.000000 2.919756 -0.000000\n0.000000 -0.000000 6.650249\nZr Al Ni\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Zr\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.212380 Ni\n0.500001 0.500001 0.787620 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 6.900478943358498,
"density_atomic": 0.07055518998559097,
"volume": 56.693207130714185,
"volume_molar": 8.535361836924913,
"formula_full": "Zr1 Al1 Ni2",
"formula_reduced": "ZrAlNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.885230525,
"spacegroup": 123
},
{
"id": "jvasp-18571",
"created_at": "2022-09-04T14:36:58.081598Z",
"updated_at": "2022-09-04T14:36:58.081618Z",
"structure_string": "Zr1 Al5 Ni2\n1.0\n3.896137 0.000000 -1.045646\n-0.280630 3.886017 -1.045646\n0.016575 0.017816 7.843202\nZr Al Ni\n1 5 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 -0.000000 Al\n0.648075 0.148075 0.296149 Al\n0.148075 0.648075 0.296149 Al\n0.351927 0.851927 0.703850 Al\n0.851927 0.351927 0.703850 Al\n0.238743 0.238743 0.477484 Ni\n0.761259 0.761259 0.522515 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 4.797735941107623,
"density_atomic": 0.06728637151222215,
"volume": 118.89480470122912,
"volume_molar": 8.950015619293895,
"formula_full": "Zr1 Al5 Ni2",
"formula_reduced": "ZrAl5Ni2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.0837304125,
"spacegroup": 139
},
{
"id": "jvasp-15629",
"created_at": "2022-09-04T14:36:55.248938Z",
"updated_at": "2022-09-04T14:36:55.248952Z",
"structure_string": "Zr3 Al3 Ni3\n1.0\n3.436969 -5.953005 -0.000000\n3.436969 5.953005 -0.000000\n-0.000000 0.000000 3.544820\nZr Al Ni\n3 3 3\ndirect\n0.590326 -0.000000 0.500000 Zr\n0.409674 0.409674 0.500000 Zr\n-0.000000 0.590326 0.500000 Zr\n0.248348 -0.000000 0.000000 Al\n0.751652 0.751652 0.000000 Al\n-0.000000 0.248348 0.000000 Al\n0.000000 0.000000 0.500000 Ni\n0.333333 0.666667 0.000000 Ni\n0.666667 0.333333 0.000000 Ni\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 6.075185370675039,
"density_atomic": 0.06204495360031698,
"volume": 145.05611621497,
"volume_molar": 9.706092777171861,
"formula_full": "Zr3 Al3 Ni3",
"formula_reduced": "ZrAlNi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8561732333333336,
"spacegroup": 189
}
]
}