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=-density&page=4018",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4016",
"results": [
{
"id": "jvasp-113571",
"created_at": "2022-09-04T14:38:47.726847Z",
"updated_at": "2022-09-04T14:38:47.726879Z",
"structure_string": "Ca1 Zr1 S3\n1.0\n4.967768 -0.000000 -0.000000\n0.000000 4.967768 -0.000000\n0.000000 0.000000 4.967768\nCa Zr S\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Zr\n0.500000 0.500000 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Zr",
"S"
],
"chemical_system": "Ca-S-Zr",
"density": 3.081348747158883,
"density_atomic": 0.04078364965791441,
"volume": 122.59815004147644,
"volume_molar": 14.766066329307419,
"formula_full": "Ca1 Zr1 S3",
"formula_reduced": "CaZrS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.711680984,
"spacegroup": 221
},
{
"id": "jvasp-12682",
"created_at": "2022-09-04T14:37:11.005611Z",
"updated_at": "2022-09-04T14:37:11.005642Z",
"structure_string": "Li2 Ti2 P2 O8 F2\n1.0\n5.195155 -0.010697 -0.004141\n-0.740733 5.348901 -0.008787\n-2.371341 -2.427678 6.554340\nLi Ti P O F\n2 2 2 8 2\ndirect\n0.261350 0.613264 0.182736 Li\n0.738649 0.386735 0.817264 Li\n0.000000 0.000000 0.000000 Ti\n0.000000 -0.000000 0.500000 Ti\n0.319811 0.633668 0.765733 P\n0.680189 0.366331 0.234266 P\n0.370767 0.237941 0.082398 O\n0.681503 0.660515 0.335349 O\n0.318497 0.339484 0.664650 O\n0.763140 0.225592 0.389510 O\n0.629232 0.762057 0.917601 O\n0.236860 0.774406 0.610489 O\n0.874010 0.348287 0.109586 O\n0.125989 0.651712 0.890414 O\n0.139500 0.928516 0.267785 F\n0.860499 0.071483 0.732215 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Li",
"Ti",
"P",
"O",
"F"
],
"chemical_system": "F-Li-O-P-Ti",
"density": 3.0813017935140974,
"density_atomic": 0.08795487063835074,
"volume": 181.91147214334666,
"volume_molar": 6.846853069412828,
"formula_full": "Li2 Ti2 P2 O8 F2",
"formula_reduced": "LiTiPO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 2.128503514479166,
"spacegroup": 2
},
{
"id": "jvasp-96978",
"created_at": "2022-09-04T14:36:54.095066Z",
"updated_at": "2022-09-04T14:36:54.095097Z",
"structure_string": "K8 V4 O8 F12\n1.0\n5.659324 0.000000 0.000000\n-0.000000 7.303742 0.000000\n0.000000 0.000000 11.376050\nK V O F\n8 4 8 12\ndirect\n0.749999 0.812627 0.589413 K\n0.250000 0.187373 0.410587 K\n0.749999 0.312627 0.910587 K\n0.250000 0.687373 0.089413 K\n0.749999 0.526665 0.284984 K\n0.250000 0.473334 0.715016 K\n0.749999 0.026666 0.215016 K\n0.250000 0.973334 0.784984 K\n0.749999 0.796533 0.928779 V\n0.749999 0.296533 0.571220 V\n0.250000 0.703467 0.428779 V\n0.250000 0.203467 0.071220 V\n0.019709 0.327179 0.114395 O\n0.519709 0.672821 0.885605 O\n0.980290 0.172821 0.614395 O\n0.019709 0.827179 0.385605 O\n0.519709 0.172821 0.614395 O\n0.480290 0.327179 0.114395 O\n0.980290 0.672821 0.885605 O\n0.480290 0.827179 0.385605 O\n0.749999 0.468154 0.694961 F\n0.250000 0.031846 0.194961 F\n0.749999 0.968154 0.805039 F\n0.500000 0.000000 0.000000 F\n0.250000 0.275527 0.909314 F\n0.500000 0.500000 0.500000 F\n0.749999 0.224473 0.409314 F\n0.250000 0.775526 0.590686 F\n0.000000 0.000000 0.000000 F\n0.250000 0.531846 0.305039 F\n0.000000 0.500000 0.500000 F\n0.749999 0.724473 0.090686 F\n",
"nsites": 32,
"nelements": 4,
"elements": [
"K",
"V",
"O",
"F"
],
"chemical_system": "F-K-O-V",
"density": 3.081251969469336,
"density_atomic": 0.06805319260006472,
"volume": 470.2204081454008,
"volume_molar": 8.849167143988295,
"formula_full": "K8 V4 O8 F12",
"formula_reduced": "K2VO2F3",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 0.6449960059375,
"spacegroup": 62
},
{
"id": "jvasp-117340",
"created_at": "2022-09-04T14:38:26.436691Z",
"updated_at": "2022-09-04T14:38:26.436712Z",
"structure_string": "La6 Mg23 P1\n1.0\n8.898631 0.000000 5.137627\n2.966210 8.389710 5.137627\n-0.000000 -0.000000 10.275254\nLa Mg P\n6 23 1\ndirect\n0.797528 0.797528 0.202473 La\n0.202472 0.797528 0.202473 La\n0.797528 0.202472 0.202473 La\n0.202472 0.202472 0.797528 La\n0.797528 0.202472 0.797528 La\n0.202472 0.797528 0.797528 La\n0.378318 0.865046 0.378318 Mg\n0.865046 0.378318 0.378318 Mg\n0.378318 0.378318 0.378318 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n-0.000000 0.500000 0.500000 Mg\n0.378318 0.378318 0.865046 Mg\n-0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.621682 0.621682 0.621682 Mg\n0.621682 0.621682 0.134955 Mg\n0.621682 0.134954 0.621682 Mg\n0.500000 0.500000 0.500000 Mg\n0.171552 0.171552 0.171552 Mg\n0.485343 0.171552 0.171552 Mg\n0.171552 0.485343 0.171552 Mg\n0.171552 0.171552 0.485343 Mg\n0.828448 0.828448 0.828448 Mg\n0.514657 0.828448 0.828448 Mg\n0.828448 0.514657 0.828448 Mg\n0.828448 0.828448 0.514657 Mg\n0.134954 0.621682 0.621682 Mg\n0.000000 0.000000 0.000000 P\n",
"nsites": 30,
"nelements": 3,
"elements": [
"La",
"Mg",
"P"
],
"chemical_system": "La-Mg-P",
"density": 3.0812002903482374,
"density_atomic": 0.03910736376197992,
"volume": 767.1189544401334,
"volume_molar": 15.398994411008367,
"formula_full": "La6 Mg23 P1",
"formula_reduced": "La6Mg23P",
"formula_anonymous": "AB6C23",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-114481",
"created_at": "2022-09-04T14:38:41.246917Z",
"updated_at": "2022-09-04T14:38:41.246943Z",
"structure_string": "B2 C1 Cl2\n1.0\n2.842872 0.000000 0.000000\n-1.421436 2.461999 -0.000000\n0.000000 0.000000 8.049579\nB C Cl\n2 1 2\ndirect\n0.666665 0.333333 0.394906 B\n0.333332 0.666667 0.605093 B\n0.000000 0.000000 0.500000 C\n0.666665 0.333333 0.796272 Cl\n0.333332 0.666667 0.203728 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"B",
"C",
"Cl"
],
"chemical_system": "B-C-Cl",
"density": 3.0811145673362548,
"density_atomic": 0.08874658680755358,
"volume": 56.3401949287635,
"volume_molar": 6.785771686137039,
"formula_full": "B2 C1 Cl2",
"formula_reduced": "B2CCl2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.3891446603333337,
"spacegroup": 164
},
{
"id": "jvasp-101064",
"created_at": "2022-09-04T14:36:58.976196Z",
"updated_at": "2022-09-04T14:36:58.976215Z",
"structure_string": "Mn2 Si2 P4\n1.0\n4.982353 0.008547 -4.120694\n-1.098301 4.859800 -4.120694\n-0.006819 -0.008547 6.465595\nMn Si P\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Mn\n0.500000 0.500000 0.000001 Mn\n0.749999 0.250000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.642079 0.625000 0.517080 P\n0.107920 0.125000 0.482920 P\n0.375000 0.892080 0.017081 P\n0.874999 0.357920 0.982920 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Si",
"P"
],
"chemical_system": "Mn-P-Si",
"density": 3.0810849377367098,
"density_atomic": 0.05119566910271847,
"volume": 156.26321796769335,
"volume_molar": 11.762988677650132,
"formula_full": "Mn2 Si2 P4",
"formula_reduced": "MnSiP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.305039210344828,
"spacegroup": 122
},
{
"id": "jvasp-121251",
"created_at": "2022-09-04T14:38:52.956118Z",
"updated_at": "2022-09-04T14:38:52.956136Z",
"structure_string": "Na1 Nb1 S3\n1.0\n4.853321 0.000000 -0.000000\n0.000000 4.853321 0.000000\n0.000000 0.000000 4.853321\nNa Nb S\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"Nb",
"S"
],
"chemical_system": "Na-Nb-S",
"density": 3.0807367767430254,
"density_atomic": 0.04373739918768049,
"volume": 114.31864017667401,
"volume_molar": 13.768858852714443,
"formula_full": "Na1 Nb1 S3",
"formula_reduced": "NaNbS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.05338168,
"spacegroup": 221
},
{
"id": "jvasp-47796",
"created_at": "2022-09-04T14:36:40.374858Z",
"updated_at": "2022-09-04T14:36:40.374882Z",
"structure_string": "Li4 Fe2 Si2 O8\n1.0\n3.670583 3.853442 0.000000\n-3.670583 3.853442 0.000000\n0.000000 0.000000 6.166559\nLi Fe Si O\n4 2 2 8\ndirect\n0.320746 0.679254 0.500000 Li\n0.187740 0.187740 0.750000 Li\n0.812259 0.812259 0.250000 Li\n0.679254 0.320746 0.000000 Li\n0.177066 0.177066 0.250000 Fe\n0.822934 0.822934 0.750000 Fe\n0.321807 0.678192 0.000000 Si\n0.678192 0.321807 0.500000 Si\n0.189622 0.798899 0.221716 O\n0.201101 0.810377 0.778284 O\n0.292448 0.369804 -0.001612 O\n0.630196 0.707551 0.001612 O\n0.369804 0.292448 0.501612 O\n0.707551 0.630196 0.498388 O\n0.810377 0.201101 0.721716 O\n0.798899 0.189622 0.278284 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.0805478368544184,
"density_atomic": 0.09171982563690065,
"volume": 174.44429150291464,
"volume_molar": 6.565800488806399,
"formula_full": "Li4 Fe2 Si2 O8",
"formula_reduced": "Li2FeSiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.2792335124999994,
"spacegroup": 20
},
{
"id": "jvasp-48544",
"created_at": "2022-09-04T14:36:55.331668Z",
"updated_at": "2022-09-04T14:36:55.331686Z",
"structure_string": "Li2 V1 F4\n1.0\n5.156880 0.041755 0.000000\n1.912138 4.789456 0.000000\n0.000000 0.000000 3.083262\nLi V F\n2 1 4\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 V\n0.240609 0.240609 0.000000 F\n0.237757 0.762244 0.500000 F\n0.762243 0.237758 0.500000 F\n0.759391 0.759392 0.000000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.0805415573219257,
"density_atomic": 0.09221903615924203,
"volume": 75.90623684151868,
"volume_molar": 6.53025775459319,
"formula_full": "Li2 V1 F4",
"formula_reduced": "Li2VF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.4366993328571428,
"spacegroup": 65
},
{
"id": "jvasp-45776",
"created_at": "2022-09-04T14:38:00.089688Z",
"updated_at": "2022-09-04T14:38:00.089711Z",
"structure_string": "Li4 V4 F16\n1.0\n0.000000 5.229115 -0.088600\n5.577814 0.000000 0.000000\n0.000000 -3.962146 -9.829829\nLi V F\n4 4 16\ndirect\n0.368190 0.132702 0.207330 Li\n0.631809 0.632701 0.292670 Li\n0.368189 0.367298 0.707330 Li\n0.631809 0.867298 0.792670 Li\n0.761193 0.151968 0.506444 V\n0.238805 0.651968 0.993556 V\n0.761193 0.348031 0.006444 V\n0.238805 0.848031 0.493556 V\n-0.009227 0.133432 0.126944 F\n-0.014087 0.619729 0.096555 F\n0.526079 0.149459 0.865350 F\n0.503681 0.614244 0.892511 F\n0.014086 0.119729 0.403445 F\n0.009227 0.633431 0.373056 F\n-0.009228 0.366568 0.626944 F\n0.014086 0.380271 0.903446 F\n0.496318 0.385755 0.107489 F\n0.473919 0.850540 0.134650 F\n0.473919 0.649459 0.634650 F\n0.009226 0.866568 0.873056 F\n0.526079 0.350541 0.365350 F\n0.503681 0.885755 0.392511 F\n-0.014087 0.880270 0.596555 F\n0.496317 0.114245 0.607489 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.0804776281493442,
"density_atomic": 0.0831413588421301,
"volume": 288.6649957883358,
"volume_molar": 7.243255154675689,
"formula_full": "Li4 V4 F16",
"formula_reduced": "LiVF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.327532555,
"spacegroup": 14
},
{
"id": "jvasp-52213",
"created_at": "2022-09-04T14:38:29.304363Z",
"updated_at": "2022-09-04T14:38:29.304383Z",
"structure_string": "Na1 Ti1 S2\n1.0\n1.758727 -3.046205 -0.000000\n1.758727 3.046205 0.000000\n-0.000000 0.000000 6.791501\nNa Ti S\n1 1 2\ndirect\n0.000000 -0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Ti\n0.333334 0.666667 0.787667 S\n0.666667 0.333334 0.212333 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ti",
"S"
],
"chemical_system": "Na-S-Ti",
"density": 3.0802571794116216,
"density_atomic": 0.054967586576875394,
"volume": 72.77015872628436,
"volume_molar": 10.95580347443067,
"formula_full": "Na1 Ti1 S2",
"formula_reduced": "NaTiS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3531818333333332,
"spacegroup": 164
},
{
"id": "jvasp-47725",
"created_at": "2022-09-04T14:38:33.289472Z",
"updated_at": "2022-09-04T14:38:33.289500Z",
"structure_string": "Li2 Fe2 P4 H2 O16\n1.0\n0.000000 4.757690 0.011371\n7.998810 0.000000 0.000000\n0.000000 -1.858020 -7.194030\nLi Fe P H O\n2 2 4 2 16\ndirect\n0.856562 0.625515 0.396615 Li\n0.143438 0.125515 0.603385 Li\n0.252087 0.499274 0.764451 Fe\n0.747913 -0.000726 0.235549 Fe\n0.879446 0.648576 0.011504 P\n0.120554 0.148576 0.988496 P\n0.377080 0.847442 0.501151 P\n0.622920 0.347442 0.498849 P\n0.717134 0.985804 0.736695 H\n0.282866 0.485804 0.263305 H\n0.607330 0.827859 0.385193 O\n0.499652 0.446619 0.316210 O\n0.378887 0.048154 0.113312 O\n0.209759 0.325514 0.948400 O\n0.500348 0.946619 0.683790 O\n0.392670 0.327859 0.614807 O\n0.106333 0.665080 0.890561 O\n0.893667 0.165080 0.109439 O\n0.263891 0.677961 0.542395 O\n0.124676 0.963327 0.396479 O\n0.000278 0.553620 0.190830 O\n0.736109 0.177961 0.457606 O\n0.790241 0.825514 0.051600 O\n0.875324 0.463327 0.603521 O\n0.999722 0.053620 0.809170 O\n0.621113 0.548154 0.886688 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Li",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-Li-O-P",
"density": 3.0799007069980275,
"density_atomic": 0.09502715881851383,
"volume": 273.60599141615614,
"volume_molar": 6.337283819567092,
"formula_full": "Li2 Fe2 P4 H2 O16",
"formula_reduced": "LiFeP2HO8",
"formula_anonymous": "ABCD2E8",
"energy_above_hull": 2.8732165,
"spacegroup": 4
}
]
}