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=98",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=96",
"results": [
{
"id": "jvasp-114309",
"created_at": "2022-09-04T14:38:40.314557Z",
"updated_at": "2022-09-04T14:38:40.314575Z",
"structure_string": "Al1 H1 N1\n1.0\n3.325209 -0.000000 0.000000\n-1.662604 2.879715 -0.000000\n0.000000 0.000000 3.886121\nAl H N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.333335 0.666668 0.000000 H\n0.666668 0.333334 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"H",
"N"
],
"chemical_system": "Al-H-N",
"density": 1.8740194617809316,
"density_atomic": 0.08061882794539031,
"volume": 37.2121510130629,
"volume_molar": 7.469893712768047,
"formula_full": "Al1 H1 N1",
"formula_reduced": "AlHN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.92211535,
"spacegroup": 187
},
{
"id": "jvasp-114311",
"created_at": "2022-09-04T14:38:40.189685Z",
"updated_at": "2022-09-04T14:38:40.189717Z",
"structure_string": "Al1 H1 N2\n1.0\n2.819239 0.000000 0.000000\n0.000000 2.819239 0.000000\n0.000000 0.000000 4.028339\nAl H N\n1 1 2\ndirect\n0.500000 0.500000 0.468999 Al\n0.000000 0.000000 0.164766 H\n0.000000 0.000000 0.423012 N\n0.500000 0.500000 0.953224 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"H",
"N"
],
"chemical_system": "Al-H-N",
"density": 2.904488411540169,
"density_atomic": 0.12493099278741934,
"volume": 32.017675604374155,
"volume_molar": 4.8203737324389815,
"formula_full": "Al1 H1 N2",
"formula_reduced": "AlHN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.658539824999999,
"spacegroup": 99
},
{
"id": "jvasp-113653",
"created_at": "2022-09-04T14:38:46.720353Z",
"updated_at": "2022-09-04T14:38:46.720370Z",
"structure_string": "Al2 H2 O2\n1.0\n3.376998 0.000000 0.000000\n0.000000 3.376998 0.000000\n0.000000 -0.000000 4.587941\nAl H O\n2 2 2\ndirect\n0.000000 0.500000 0.694159 Al\n0.500000 0.000000 0.305840 Al\n0.000000 0.000000 0.000000 H\n0.500000 0.500000 0.000000 H\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.7921744753876663,
"density_atomic": 0.1146758107382706,
"volume": 52.32140903450032,
"volume_molar": 5.251448166121611,
"formula_full": "Al2 H2 O2",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5139621000000003,
"spacegroup": 129
},
{
"id": "jvasp-113650",
"created_at": "2022-09-04T14:38:48.523604Z",
"updated_at": "2022-09-04T14:38:48.523624Z",
"structure_string": "Al1 H1 O1\n1.0\n4.779324 0.988332 0.000000\n-0.643031 2.990091 0.000000\n0.000000 0.000000 4.046909\nAl H O\n1 1 1\ndirect\n0.388954 0.167337 0.000000 Al\n0.066122 0.163366 0.000000 H\n0.544923 0.669296 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 1.2092636168305189,
"density_atomic": 0.04966497863178114,
"volume": 60.404737556461335,
"volume_molar": 12.125527737862287,
"formula_full": "Al1 H1 O1",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.542448766666667,
"spacegroup": 25
},
{
"id": "jvasp-113646",
"created_at": "2022-09-04T14:38:47.997522Z",
"updated_at": "2022-09-04T14:38:47.997545Z",
"structure_string": "Al1 H1 O1\n1.0\n3.364259 -0.000000 -0.000000\n-1.682130 2.913534 -0.000000\n0.000000 0.000000 3.845451\nAl H O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.333333 0.666666 0.000000 H\n0.666667 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 1.937917091305229,
"density_atomic": 0.07959109129744607,
"volume": 37.69266071234614,
"volume_molar": 7.566350280955678,
"formula_full": "Al1 H1 O1",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.783688766666667,
"spacegroup": 187
},
{
"id": "jvasp-113649",
"created_at": "2022-09-04T14:38:45.530436Z",
"updated_at": "2022-09-04T14:38:45.530463Z",
"structure_string": "Al1 H2 O2\n1.0\n2.911883 0.000000 -0.000000\n-1.455942 2.521765 0.000000\n-0.000000 -0.000000 5.721107\nAl H O\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666665 0.333333 0.357368 H\n0.333332 0.666666 0.642632 H\n0.333332 0.666666 0.835522 O\n0.666665 0.333333 0.164479 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.410978877755766,
"density_atomic": 0.1190176580573275,
"volume": 42.01057289828068,
"volume_molar": 5.0598716680337485,
"formula_full": "Al1 H2 O2",
"formula_reduced": "Al(HO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.19427796,
"spacegroup": 164
},
{
"id": "jvasp-113647",
"created_at": "2022-09-04T14:38:46.693413Z",
"updated_at": "2022-09-04T14:38:46.693438Z",
"structure_string": "Al1 H1 O2\n1.0\n1.391666 0.803479 4.301392\n-1.391666 0.803479 4.301392\n-0.000000 -1.606957 4.301392\nAl H O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 H\n0.245128 0.245128 0.245128 O\n0.754872 0.754872 0.754872 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.451801845072441,
"density_atomic": 0.13860865541714396,
"volume": 28.85822669559823,
"volume_molar": 4.344707581122056,
"formula_full": "Al1 H1 O2",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.86460495,
"spacegroup": 166
},
{
"id": "jvasp-54695",
"created_at": "2022-09-04T14:37:54.987906Z",
"updated_at": "2022-09-04T14:37:54.987940Z",
"structure_string": "Al4 H4 O8\n1.0\n2.874277 -0.000000 0.000000\n0.000000 4.920564 0.000000\n0.000000 0.000000 8.470826\nAl H O\n4 4 8\ndirect\n0.250000 0.387499 0.647164 Al\n0.250000 0.112500 0.147164 Al\n0.750001 0.612500 0.352837 Al\n0.750001 0.887499 0.852837 Al\n0.750001 0.366669 0.923083 H\n0.750001 0.133331 0.423082 H\n0.250000 0.633330 0.076918 H\n0.250000 0.866669 0.576918 H\n0.750001 0.209471 0.000826 O\n0.750001 0.290529 0.500826 O\n0.250000 0.790528 0.999175 O\n0.250000 0.709470 0.499174 O\n0.750001 0.958543 0.260656 O\n0.750001 0.541455 0.760656 O\n0.250000 0.041456 0.739345 O\n0.250000 0.458544 0.239345 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.3258773007168703,
"density_atomic": 0.13355209870834603,
"volume": 119.80343367677918,
"volume_molar": 4.509207132080554,
"formula_full": "Al4 H4 O8",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6474824499999998,
"spacegroup": 62
},
{
"id": "jvasp-34788",
"created_at": "2022-09-04T14:37:13.881855Z",
"updated_at": "2022-09-04T14:37:13.881874Z",
"structure_string": "Al2 H2 O4\n1.0\n2.859196 0.000000 0.000000\n0.000000 4.247368 0.000000\n0.000000 0.000000 4.751123\nAl H O\n2 2 4\ndirect\n0.500001 0.273706 0.492043 Al\n0.000000 0.726295 0.992043 Al\n0.500001 0.200011 0.976589 H\n0.000000 0.799990 0.476589 H\n0.000000 0.502501 0.649225 O\n0.500001 0.497500 0.149225 O\n0.000000 -0.001566 0.347552 O\n0.500001 0.001566 0.847551 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.4529111299996864,
"density_atomic": 0.13865319925225994,
"volume": 57.697911358288444,
"volume_molar": 4.343311796970198,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.65109245,
"spacegroup": 31
},
{
"id": "jvasp-12038",
"created_at": "2022-09-04T14:35:55.207450Z",
"updated_at": "2022-09-04T14:35:55.207482Z",
"structure_string": "Al2 H2 O4\n1.0\n2.161109 6.332083 0.000000\n-0.729078 5.987100 0.000000\n0.000000 0.000000 3.751249\nAl H O\n2 2 4\ndirect\n0.749325 0.613524 0.250000 Al\n0.250674 0.386476 0.750000 Al\n0.247290 0.754636 0.250000 H\n0.752710 0.245363 0.750000 H\n0.250371 0.327824 0.250000 O\n0.749628 0.672176 0.750000 O\n0.248386 -0.085039 0.250000 O\n0.751614 0.085039 0.750000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.025240510884653,
"density_atomic": 0.12147989321165545,
"volume": 65.85451952992362,
"volume_molar": 4.957314828642114,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.65872995,
"spacegroup": 59
},
{
"id": "jvasp-90648",
"created_at": "2022-09-04T14:36:12.673773Z",
"updated_at": "2022-09-04T14:36:12.673805Z",
"structure_string": "Al2 H2 O4\n1.0\n0.000000 0.000000 -2.858431\n-0.000000 -4.184933 0.000000\n-4.725179 -0.000000 0.000000\nAl H O\n2 2 4\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 H\n0.000000 0.000000 0.500000 H\n0.500000 0.739090 0.145979 O\n0.500000 0.260909 0.854022 O\n0.000000 0.760909 0.645979 O\n0.000000 0.239091 0.354022 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.5246094810907986,
"density_atomic": 0.14153227878417232,
"volume": 56.52420824933858,
"volume_molar": 4.254959230313376,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.65413745,
"spacegroup": 58
},
{
"id": "jvasp-29798",
"created_at": "2022-09-04T14:37:20.152611Z",
"updated_at": "2022-09-04T14:37:20.152641Z",
"structure_string": "Al4 H4 O8\n1.0\n3.703961 0.000000 0.000000\n0.000000 12.371594 0.000000\n0.000000 0.000000 2.887760\nAl H O\n4 4 8\ndirect\n0.750509 0.568167 0.270515 Al\n0.749490 0.068167 0.270515 Al\n0.249490 0.431833 0.770515 Al\n0.250509 0.931832 0.770515 Al\n0.568834 0.224478 0.770514 H\n0.931166 0.724477 0.770514 H\n0.431166 0.775522 0.270515 H\n0.068834 0.275523 0.270515 H\n0.750973 0.960436 0.770514 O\n0.749027 0.460436 0.770514 O\n0.249027 0.039564 0.270514 O\n0.250973 0.539564 0.270514 O\n0.757552 0.168872 0.770517 O\n0.742448 0.668872 0.770517 O\n0.242448 0.831127 0.270517 O\n0.257552 0.331127 0.270517 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.0110802314392737,
"density_atomic": 0.12091128082243129,
"volume": 132.32843032650848,
"volume_molar": 4.980627712350543,
"formula_full": "Al4 H4 O8",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6534999499999998,
"spacegroup": 62
}
]
}