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_anonymous&page=296",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=294",
"results": [
{
"id": "jvasp-120591",
"created_at": "2022-09-04T14:38:51.522193Z",
"updated_at": "2022-09-04T14:38:51.522220Z",
"structure_string": "Li3 Fe3 O8\n1.0\n4.949538 0.045802 2.981427\n1.706825 4.646157 2.981427\n0.064978 0.045802 5.777769\nLi Fe O\n3 3 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.379216 0.379216 0.379216 Li\n0.620784 0.620784 0.620785 Li\n-0.000001 0.500000 0.000000 Fe\n0.500000 -0.000000 0.000000 Fe\n0.000000 -0.000000 0.500000 Fe\n0.249196 0.249196 0.789809 O\n0.789809 0.249196 0.249197 O\n0.249195 0.789809 0.249197 O\n0.761705 0.761705 0.761706 O\n0.750804 0.750804 0.210192 O\n0.210191 0.750804 0.750805 O\n0.750804 0.210191 0.750805 O\n0.238295 0.238295 0.238295 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 4.007550460681261,
"density_atomic": 0.10680355431685802,
"volume": 131.08177990468076,
"volume_molar": 5.638520926123764,
"formula_full": "Li3 Fe3 O8",
"formula_reduced": "Li3Fe3O8",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 2.6733074642857138,
"spacegroup": 166
},
{
"id": "jvasp-45869",
"created_at": "2022-09-04T14:38:05.642939Z",
"updated_at": "2022-09-04T14:38:05.642957Z",
"structure_string": "Mg3 Fe3 O8\n1.0\n0.001852 4.162762 4.162762\n4.162762 0.001852 4.162762\n4.162762 4.162762 0.001852\nMg Fe O\n3 3 8\ndirect\n0.625000 0.125000 0.625000 Mg\n0.625000 0.625000 0.125000 Mg\n0.125000 0.625000 0.625000 Mg\n0.993782 0.993782 0.993782 Fe\n0.256217 0.256217 0.256217 Fe\n0.625000 0.625000 0.625000 Fe\n0.855203 0.393160 0.393160 O\n0.382777 0.382777 0.382777 O\n0.393160 0.855203 0.393160 O\n0.393160 0.393160 0.855203 O\n0.856839 0.394796 0.856839 O\n0.856839 0.856839 0.394796 O\n0.394796 0.856839 0.856839 O\n0.867222 0.867222 0.867222 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O",
"density": 4.243626782682752,
"density_atomic": 0.09710536317985459,
"volume": 144.17329323067122,
"volume_molar": 6.2016561833418375,
"formula_full": "Mg3 Fe3 O8",
"formula_reduced": "Mg3Fe3O8",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 2.237147260714285,
"spacegroup": 166
},
{
"id": "jvasp-88869",
"created_at": "2022-09-04T14:36:03.909562Z",
"updated_at": "2022-09-04T14:36:03.909571Z",
"structure_string": "Zn8 B3 H3 O14\n1.0\n6.864912 -0.056522 3.198423\n2.015522 6.562613 3.198423\n-0.077150 -0.056522 7.573042\nZn B H O\n8 3 3 14\ndirect\n0.407402 0.407403 0.407402 Zn\n0.516879 0.770383 0.956573 Zn\n0.770382 0.956574 0.516879 Zn\n0.483121 0.043427 0.229617 Zn\n0.956573 0.516880 0.770382 Zn\n0.229617 0.483121 0.043426 Zn\n0.592597 0.592598 0.592597 Zn\n0.043426 0.229617 0.483121 Zn\n0.797528 0.500000 0.202471 B\n0.202471 0.797529 0.500000 B\n0.500000 0.202472 0.797528 B\n0.862836 0.000000 0.137163 H\n0.137164 0.862836 -0.000000 H\n-0.000000 0.137164 0.862836 H\n0.610299 0.541646 0.181948 O\n0.745003 0.000000 0.254996 O\n0.704299 0.704300 0.704299 O\n-0.000000 0.254997 0.745003 O\n0.458353 0.389701 0.818051 O\n0.389700 0.818051 0.458353 O\n0.032741 0.967259 0.500000 O\n0.541646 0.181949 0.610299 O\n0.254996 0.745003 -0.000000 O\n0.181948 0.610300 0.541646 O\n0.818051 0.458354 0.389700 O\n0.967259 0.500000 0.032741 O\n0.295700 0.295700 0.295700 O\n0.500000 0.032742 0.967258 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Zn",
"B",
"H",
"O"
],
"chemical_system": "B-H-O-Zn",
"density": 3.7722587477034266,
"density_atomic": 0.08126503825600118,
"volume": 344.5516128571106,
"volume_molar": 7.410493970394807,
"formula_full": "Zn8 B3 H3 O14",
"formula_reduced": "Zn8B3H3O14",
"formula_anonymous": "A3B3C8D14",
"energy_above_hull": 1.8751599982142857,
"spacegroup": 155
},
{
"id": "jvasp-86963",
"created_at": "2022-09-04T14:36:08.494541Z",
"updated_at": "2022-09-04T14:36:08.494564Z",
"structure_string": "Fe3 S4\n1.0\n3.242582 -0.016262 10.448919\n1.570478 2.836936 10.448919\n-0.027751 -0.016262 10.940451\nFe S\n3 4\ndirect\n0.584111 0.584114 0.584111 Fe\n0.415887 0.415889 0.415887 Fe\n0.499999 0.500001 0.499999 Fe\n0.872100 0.872104 0.872100 S\n0.127898 0.127899 0.127898 S\n0.713632 0.713636 0.713632 S\n0.286366 0.286367 0.286366 S\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 4.813969154811342,
"density_atomic": 0.06860589229775155,
"volume": 102.032052431004,
"volume_molar": 8.777876882445804,
"formula_full": "Fe3 S4",
"formula_reduced": "Fe3S4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.8573366428571427,
"spacegroup": 166
},
{
"id": "jvasp-85405",
"created_at": "2022-09-04T14:35:59.692269Z",
"updated_at": "2022-09-04T14:35:59.692291Z",
"structure_string": "Eu6 As8\n1.0\n5.205034 -0.000408 1.738895\n2.602903 7.498620 0.870350\n0.005105 -0.000746 8.661578\nEu As\n6 8\ndirect\n0.455452 0.496673 0.166813 Eu\n0.117810 0.505564 0.832173 Eu\n0.372409 0.996427 0.332166 Eu\n0.701145 0.005333 0.666824 Eu\n0.000728 0.000975 -0.000478 Eu\n0.750695 0.501012 0.499511 Eu\n0.587963 0.781253 0.958026 As\n0.743359 0.309802 0.818126 As\n0.118273 0.720713 0.458062 As\n0.871575 0.692246 0.181265 As\n0.802152 0.192194 0.318121 As\n0.295068 0.279985 0.542187 As\n0.324120 0.221975 0.042162 As\n0.312813 0.809741 0.681259 As\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Eu",
"As"
],
"chemical_system": "As-Eu",
"density": 7.423870560047251,
"density_atomic": 0.04141901814352051,
"volume": 338.0089781821669,
"volume_molar": 14.53955460540556,
"formula_full": "Eu6 As8",
"formula_reduced": "Eu3As4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.086932428571428,
"spacegroup": 43
},
{
"id": "jvasp-86345",
"created_at": "2022-09-04T14:36:00.257695Z",
"updated_at": "2022-09-04T14:36:00.257714Z",
"structure_string": "Re3 P4\n1.0\n2.969510 -0.000000 -0.735462\n-0.597259 5.564867 -2.411499\n-0.000467 0.013364 6.360711\nRe P\n3 4\ndirect\n0.263818 0.318760 0.527638 Re\n0.736180 0.681240 0.472362 Re\n0.000000 0.000000 0.000000 Re\n0.086313 0.436126 0.172627 P\n0.913685 0.563873 0.827373 P\n0.352022 0.024924 0.704044 P\n0.647977 0.975076 0.295956 P\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Re",
"P"
],
"chemical_system": "P-Re",
"density": 10.772218338248562,
"density_atomic": 0.06653363058646074,
"volume": 105.20995079177995,
"volume_molar": 9.051273328868175,
"formula_full": "Re3 P4",
"formula_reduced": "Re3P4",
"formula_anonymous": "A3B4",
"energy_above_hull": 5.284008,
"spacegroup": 12
},
{
"id": "jvasp-50336",
"created_at": "2022-09-04T14:36:06.724408Z",
"updated_at": "2022-09-04T14:36:06.724428Z",
"structure_string": "Hf6 N8\n1.0\n-4.529355 4.529355 0.000000\n4.529355 -0.000000 4.529355\n4.529355 4.529355 -0.000000\nHf N\n6 8\ndirect\n0.500001 0.000000 0.000000 Hf\n0.500001 0.000000 0.500001 Hf\n0.125000 0.250000 0.125000 Hf\n0.500001 0.500001 0.500001 Hf\n0.875001 0.750001 0.875001 Hf\n0.000000 0.500001 0.500001 Hf\n0.742226 0.484451 0.273326 N\n0.742226 0.015550 0.742226 N\n0.273326 0.015550 0.742226 N\n0.742226 0.484451 0.742226 N\n0.257775 0.515550 0.257775 N\n0.726675 0.984451 0.257775 N\n0.257775 0.515550 0.726675 N\n0.257775 0.984451 0.257775 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Hf",
"N"
],
"chemical_system": "Hf-N",
"density": 10.570424144141757,
"density_atomic": 0.0753336408204504,
"volume": 185.8399494240228,
"volume_molar": 7.993959530448187,
"formula_full": "Hf6 N8",
"formula_reduced": "Hf3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 5.778746,
"spacegroup": 227
},
{
"id": "jvasp-86352",
"created_at": "2022-09-04T14:35:44.383986Z",
"updated_at": "2022-09-04T14:35:44.384002Z",
"structure_string": "Ho6 Ge8\n1.0\n4.048174 0.000000 0.000000\n-2.024087 5.307540 0.000000\n0.000000 -0.000000 14.248574\nHo Ge\n6 8\ndirect\n0.950682 0.901369 0.250000 Ho\n0.049316 0.098631 0.750000 Ho\n0.331835 0.663672 0.596586 Ho\n0.668163 0.336328 0.403414 Ho\n0.668163 0.336328 0.096586 Ho\n0.331835 0.663672 0.903413 Ho\n0.000000 0.000000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.220478 0.440958 0.250000 Ge\n0.779520 0.559042 0.750000 Ge\n0.378248 0.756497 0.390926 Ge\n0.621750 0.243503 0.609074 Ge\n0.378248 0.756497 0.109074 Ge\n0.621750 0.243503 0.890926 Ge\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ho",
"Ge"
],
"chemical_system": "Ge-Ho",
"density": 8.519596426573111,
"density_atomic": 0.04573031430669242,
"volume": 306.1426585898441,
"volume_molar": 13.168815590490459,
"formula_full": "Ho6 Ge8",
"formula_reduced": "Ho3Ge4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.093917214285714,
"spacegroup": 63
},
{
"id": "jvasp-42551",
"created_at": "2022-09-04T14:35:43.446400Z",
"updated_at": "2022-09-04T14:35:43.446421Z",
"structure_string": "Ni6 O8\n1.0\n-2.900192 0.000830 -0.000984\n-0.001519 -4.995585 0.030871\n1.447131 0.294859 9.470904\nNi O\n6 8\ndirect\n0.000000 0.000000 0.000000 Ni\n0.374724 0.136276 0.749488 Ni\n0.742521 0.252748 0.485094 Ni\n0.500000 0.500000 0.000000 Ni\n0.257478 0.747250 0.514906 Ni\n0.625276 0.863723 0.250512 Ni\n0.192088 0.047325 0.384194 O\n0.553150 0.153221 0.106296 O\n0.941300 0.299042 0.882630 O\n0.299863 0.398162 0.599756 O\n0.700137 0.601837 0.400244 O\n0.058700 0.700957 0.117370 O\n0.446850 0.846778 0.893704 O\n0.807912 0.952674 0.615806 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ni",
"O"
],
"chemical_system": "Ni-O",
"density": 5.809855968364088,
"density_atomic": 0.10201459407839447,
"volume": 137.2352664486565,
"volume_molar": 5.903214941356533,
"formula_full": "Ni6 O8",
"formula_reduced": "Ni3O4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.9570301714285716,
"spacegroup": 12
},
{
"id": "jvasp-85852",
"created_at": "2022-09-04T14:35:46.207667Z",
"updated_at": "2022-09-04T14:35:46.207693Z",
"structure_string": "Ag6 O8\n1.0\n3.626062 0.040412 0.000000\n-1.540309 5.497290 0.000000\n0.000000 0.000000 9.297888\nAg O\n6 8\ndirect\n0.286403 0.548693 0.858304 Ag\n0.713596 0.951307 0.358303 Ag\n0.713596 0.451307 0.141697 Ag\n0.286403 0.048693 0.641697 Ag\n-0.000000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n0.042711 0.328970 0.690957 O\n0.957288 0.171030 0.190957 O\n0.957288 0.671030 0.309043 O\n0.042711 0.828970 0.809043 O\n0.478914 0.272918 0.954024 O\n0.521085 0.227081 0.454024 O\n0.478914 0.772918 0.545976 O\n0.521085 0.727081 0.045976 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ag",
"O"
],
"chemical_system": "Ag-O",
"density": 6.923776996208479,
"density_atomic": 0.07530187334720669,
"volume": 185.91834940742982,
"volume_molar": 7.997331928560036,
"formula_full": "Ag6 O8",
"formula_reduced": "Ag3O4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.4156051114285713,
"spacegroup": 14
},
{
"id": "jvasp-94927",
"created_at": "2022-09-04T14:35:46.283380Z",
"updated_at": "2022-09-04T14:35:46.283406Z",
"structure_string": "Ba3 Sc4\n1.0\n-5.540827 0.000000 1.986086\n-3.126365 4.987098 0.000000\n-5.586116 -0.028391 -6.862267\nBa Sc\n3 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.576230 0.576230 0.271313 Ba\n0.423771 0.423771 0.728687 Ba\n0.850460 0.850459 0.448624 Sc\n0.149542 0.149542 0.551376 Sc\n0.727323 0.727322 0.818035 Sc\n0.272679 0.272679 0.181965 Sc\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ba",
"Sc"
],
"chemical_system": "Ba-Sc",
"density": 4.008981456940602,
"density_atomic": 0.028556476380341905,
"volume": 245.1282821720524,
"volume_molar": 21.08852884995854,
"formula_full": "Ba3 Sc4",
"formula_reduced": "Ba3Sc4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.63353413,
"spacegroup": 166
},
{
"id": "jvasp-15057",
"created_at": "2022-09-04T14:35:44.092418Z",
"updated_at": "2022-09-04T14:35:44.092449Z",
"structure_string": "Fe3 Se4\n1.0\n3.336724 -0.000000 -0.932880\n-0.744033 5.402562 -2.661258\n-0.020724 0.017104 6.359709\nFe Se\n3 4\ndirect\n0.500000 0.500000 -0.000000 Fe\n0.238507 0.193186 0.477013 Fe\n0.761494 0.806813 0.522986 Fe\n0.864425 0.522210 0.728849 Se\n0.135576 0.477789 0.271150 Se\n0.390879 0.056056 0.781758 Se\n0.609121 0.943943 0.218242 Se\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Fe",
"Se"
],
"chemical_system": "Fe-Se",
"density": 6.997636737794102,
"density_atomic": 0.06102617513490431,
"volume": 114.70487843168635,
"volume_molar": 9.868127482490047,
"formula_full": "Fe3 Se4",
"formula_reduced": "Fe3Se4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.549687138095238,
"spacegroup": 12
}
]
}