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=id&page=985",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=983",
"results": [
{
"id": "jvasp-117177",
"created_at": "2022-09-04T14:38:48.907111Z",
"updated_at": "2022-09-04T14:38:48.907128Z",
"structure_string": "Sm8 Sb20\n1.0\n4.257145 0.000000 0.000000\n-0.000000 13.125642 2.819352\n0.000000 0.056415 14.974666\nSm Sb\n8 20\ndirect\n0.250000 0.668725 0.577861 Sm\n0.750001 0.331275 0.422139 Sm\n0.250000 0.391557 0.771489 Sm\n0.750001 0.608443 0.228511 Sm\n0.250000 0.951918 0.362671 Sm\n0.750001 0.048081 0.637330 Sm\n0.250000 0.662275 0.855223 Sm\n0.750001 0.337724 0.144777 Sm\n0.750001 0.287049 0.650510 Sb\n0.250000 0.140278 0.778776 Sb\n0.750001 0.859722 0.221224 Sb\n0.750001 0.856469 0.519864 Sb\n0.750001 0.574595 0.734913 Sb\n0.250000 0.143531 0.480136 Sb\n0.250000 0.712951 0.349490 Sb\n0.250000 0.425405 0.265087 Sb\n0.750001 0.848886 0.825692 Sb\n0.750001 0.580800 0.024510 Sb\n0.750001 0.138665 0.322364 Sb\n0.250000 0.861334 0.677636 Sb\n0.250000 0.970640 0.099128 Sb\n0.250000 0.419200 0.975490 Sb\n0.750001 0.279373 0.940213 Sb\n0.250000 0.720627 0.059787 Sb\n0.750001 0.575234 0.448035 Sb\n0.250000 0.424766 0.551966 Sb\n0.250000 0.151113 0.174308 Sb\n0.750001 0.029359 0.900872 Sb\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Sm",
"Sb"
],
"chemical_system": "Sb-Sm",
"density": 7.22564768556524,
"density_atomic": 0.033489870724971074,
"volume": 836.0736961317185,
"volume_molar": 17.981976727995274,
"formula_full": "Sm8 Sb20",
"formula_reduced": "Sm2Sb5",
"formula_anonymous": "A2B5",
"energy_above_hull": 1.7102868928571426,
"spacegroup": 11
},
{
"id": "jvasp-117179",
"created_at": "2022-09-04T14:38:49.684461Z",
"updated_at": "2022-09-04T14:38:49.684485Z",
"structure_string": "Rb6 Na4 Tl13\n1.0\n9.600564 -0.000000 -3.394312\n-4.800282 8.314333 -3.394312\n-0.000000 -0.000000 10.182936\nRb Na Tl\n6 4 13\ndirect\n0.830206 0.330207 0.500000 Rb\n0.169793 0.669793 0.500000 Rb\n0.330207 0.500000 0.830207 Rb\n0.669793 0.500000 0.169794 Rb\n0.500000 0.830206 0.330207 Rb\n0.500000 0.169793 0.669794 Rb\n0.500000 0.500000 0.500000 Na\n0.500000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.098527 0.857068 0.241457 Tl\n0.384389 0.142932 0.241457 Tl\n0.615611 0.857068 0.758543 Tl\n0.241457 0.098527 0.857069 Tl\n0.758542 0.901473 0.142932 Tl\n0.142932 0.241457 0.384389 Tl\n0.758542 0.615611 0.857069 Tl\n0.857068 0.241457 0.098527 Tl\n0.142932 0.758543 0.901474 Tl\n0.901473 0.142932 0.758543 Tl\n0.857068 0.758543 0.615611 Tl\n0.241457 0.384389 0.142932 Tl\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Rb",
"Na",
"Tl"
],
"chemical_system": "Na-Rb-Tl",
"density": 6.663500425640909,
"density_atomic": 0.028296365731669475,
"volume": 812.8252305651482,
"volume_molar": 21.282382398881637,
"formula_full": "Rb6 Na4 Tl13",
"formula_reduced": "Rb6Na4Tl13",
"formula_anonymous": "A4B6C13",
"energy_above_hull": 0.0,
"spacegroup": 204
},
{
"id": "jvasp-117180",
"created_at": "2022-09-04T14:38:48.948856Z",
"updated_at": "2022-09-04T14:38:48.948878Z",
"structure_string": "Sm8 Cr2 S14\n1.0\n9.710486 -0.000000 0.000000\n-4.855243 8.409528 0.000000\n-0.000000 -0.000000 6.759058\nSm Cr S\n8 2 14\ndirect\n0.333334 0.666667 0.165947 Sm\n0.666667 0.333333 0.665947 Sm\n0.376475 0.214264 0.214039 Sm\n0.785736 0.162211 0.214039 Sm\n0.623526 0.785736 0.714039 Sm\n0.837790 0.623525 0.214039 Sm\n0.214264 0.837789 0.714039 Sm\n0.162211 0.376475 0.714039 Sm\n0.000000 0.000000 0.041470 Cr\n0.000000 0.000000 0.541470 Cr\n0.129899 0.894058 0.309482 S\n0.894058 0.764159 0.809482 S\n0.764159 0.870101 0.309482 S\n0.105943 0.235841 0.309482 S\n0.666667 0.333333 0.051801 S\n0.333334 0.666667 0.551801 S\n0.931182 0.445910 0.455407 S\n0.068819 0.554090 0.955407 S\n0.554091 0.485271 0.455407 S\n0.485271 0.931182 0.955407 S\n0.235841 0.129899 0.809482 S\n0.514730 0.068819 0.455407 S\n0.445910 0.514730 0.955407 S\n0.870102 0.105943 0.809482 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"Cr",
"S"
],
"chemical_system": "Cr-S-Sm",
"density": 5.282274654136133,
"density_atomic": 0.04348229730705483,
"volume": 551.9487581468262,
"volume_molar": 13.849637974447436,
"formula_full": "Sm8 Cr2 S14",
"formula_reduced": "Sm4CrS7",
"formula_anonymous": "AB4C7",
"energy_above_hull": 2.3037952416666663,
"spacegroup": 173
},
{
"id": "jvasp-117184",
"created_at": "2022-09-04T14:38:47.151557Z",
"updated_at": "2022-09-04T14:38:47.151575Z",
"structure_string": "Na3 Tb1 V2 O8\n1.0\n5.883443 0.000000 0.000000\n-2.941722 5.095211 0.000000\n-0.000000 -0.000000 6.909142\nTb Na V O\n1 3 2 8\ndirect\n0.000000 0.000000 0.500000 Tb\n0.333333 0.666667 0.652534 Na\n0.666666 0.333333 0.347466 Na\n0.000000 0.000000 0.000000 Na\n0.333333 0.666667 0.207144 V\n0.666666 0.333333 0.792856 V\n0.333333 0.666667 0.966083 O\n0.666666 0.333333 0.033916 O\n0.174167 0.825833 0.302579 O\n0.825833 0.174166 0.697420 O\n0.174166 0.348333 0.302579 O\n0.825833 0.651667 0.697420 O\n0.651667 0.825833 0.302579 O\n0.348333 0.174166 0.697420 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Tb",
"Na",
"V",
"O"
],
"chemical_system": "Na-O-Tb-V",
"density": 3.670128702129256,
"density_atomic": 0.06759431843305608,
"volume": 207.11799933104274,
"volume_molar": 8.909241042150896,
"formula_full": "Na3 Tb1 V2 O8",
"formula_reduced": "Na3TbV2O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.2213751285714283,
"spacegroup": 164
},
{
"id": "jvasp-117185",
"created_at": "2022-09-04T14:38:51.357762Z",
"updated_at": "2022-09-04T14:38:51.357773Z",
"structure_string": "Nd2 In4 Cu18\n1.0\n8.487905 -0.000000 0.000000\n0.000000 8.487905 0.000000\n-0.000000 -0.000000 5.010635\nNd In Cu\n2 4 18\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 -0.000000 Nd\n0.124123 0.624123 -0.000000 In\n0.875876 0.375877 -0.000000 In\n0.624123 0.875876 -0.000000 In\n0.375877 0.124123 -0.000000 In\n0.676056 0.176056 0.752971 Cu\n0.176056 0.323943 0.752971 Cu\n0.176056 0.323943 0.247028 Cu\n0.323943 0.823943 0.247028 Cu\n0.323943 0.823943 0.752971 Cu\n0.676056 0.176056 0.247028 Cu\n0.435831 0.295270 0.500000 Cu\n0.564169 0.704729 0.500000 Cu\n0.704729 0.435831 0.500000 Cu\n0.935830 0.204730 0.500000 Cu\n0.823943 0.676056 0.752971 Cu\n0.064169 0.795270 0.500000 Cu\n0.795270 0.935830 0.500000 Cu\n0.204730 0.064169 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n0.295270 0.564169 0.500000 Cu\n0.823943 0.676056 0.247028 Cu\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Nd",
"In",
"Cu"
],
"chemical_system": "Cu-In-Nd",
"density": 8.701235867666307,
"density_atomic": 0.06648404790798261,
"volume": 360.9888500353837,
"volume_molar": 9.058023615431715,
"formula_full": "Nd2 In4 Cu18",
"formula_reduced": "NdIn2Cu9",
"formula_anonymous": "AB2C9",
"energy_above_hull": 0.0,
"spacegroup": 127
},
{
"id": "jvasp-117186",
"created_at": "2022-09-04T14:38:47.372177Z",
"updated_at": "2022-09-04T14:38:47.372202Z",
"structure_string": "La4 V4 Sb12\n1.0\n6.093437 0.000000 0.000000\n0.000000 6.351052 0.000000\n-0.000000 0.000000 13.451146\nLa V Sb\n4 4 12\ndirect\n0.250000 0.502987 0.309398 La\n0.750000 0.497013 0.690602 La\n0.250000 0.002987 0.690602 La\n0.750000 0.997012 0.309398 La\n-0.000000 0.750000 0.909461 V\n-0.000000 0.250000 0.090539 V\n0.500000 0.250000 0.090539 V\n0.500000 0.750000 0.909461 V\n0.750000 0.995193 0.784433 Sb\n0.250000 0.004807 0.215567 Sb\n0.750000 0.898151 0.064825 Sb\n0.250000 0.101849 0.935175 Sb\n0.750000 0.398151 0.935175 Sb\n-0.000000 0.250000 0.498690 Sb\n0.500000 0.750000 0.501310 Sb\n0.500000 0.250000 0.498690 Sb\n0.250000 0.504807 0.784433 Sb\n-0.000000 0.750000 0.501310 Sb\n0.250000 0.601849 0.064825 Sb\n0.750000 0.495193 0.215567 Sb\n",
"nsites": 20,
"nelements": 3,
"elements": [
"La",
"V",
"Sb"
],
"chemical_system": "La-Sb-V",
"density": 7.083275531061514,
"density_atomic": 0.03842047370231117,
"volume": 520.5557889515794,
"volume_molar": 15.674301172496321,
"formula_full": "La4 V4 Sb12",
"formula_reduced": "LaVSb3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.2392115,
"spacegroup": 57
},
{
"id": "jvasp-117188",
"created_at": "2022-09-04T14:38:46.596059Z",
"updated_at": "2022-09-04T14:38:46.596085Z",
"structure_string": "Dy12 In2 Co4\n1.0\n7.823940 0.033043 -2.775210\n-3.673189 6.758003 -3.123142\n0.029103 -0.033043 8.301505\nDy In Co\n12 2 4\ndirect\n0.442330 0.236133 0.206198 Dy\n0.676517 0.988190 0.311673 Dy\n0.323482 0.011809 0.688327 Dy\n0.676517 0.364844 0.688327 Dy\n0.815107 0.285664 0.100772 Dy\n0.184892 0.714336 0.899229 Dy\n0.323482 0.635155 0.311673 Dy\n0.184893 0.285664 0.470558 Dy\n0.970065 0.763867 0.206198 Dy\n0.029934 0.236133 0.793802 Dy\n0.557669 0.763867 0.793802 Dy\n0.815107 0.714335 0.529443 Dy\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 In\n0.113850 0.613851 0.500000 Co\n0.341106 0.000000 0.341107 Co\n0.658893 0.000000 0.658894 Co\n0.886149 0.386149 0.500000 Co\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Dy",
"In",
"Co"
],
"chemical_system": "Co-Dy-In",
"density": 9.12914598070815,
"density_atomic": 0.04097039121294799,
"volume": 439.3416676556266,
"volume_molar": 14.69876313530735,
"formula_full": "Dy12 In2 Co4",
"formula_reduced": "Dy6InCo2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.8759600855555552,
"spacegroup": 71
},
{
"id": "jvasp-117189",
"created_at": "2022-09-04T14:38:43.618895Z",
"updated_at": "2022-09-04T14:38:43.618921Z",
"structure_string": "Ba2 Nd1 Co1 Cu2 O7\n1.0\n3.920597 -0.000000 0.000000\n0.000000 3.929439 0.000000\n0.000000 -0.000000 11.780760\nBa Nd Co Cu O\n2 1 1 2 7\ndirect\n0.500000 0.500000 0.184615 Ba\n0.500000 0.500000 0.815385 Ba\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.357588 Cu\n0.000000 0.000000 0.642412 Cu\n0.500000 0.000000 0.369511 O\n0.500000 0.000000 0.630490 O\n0.000000 0.000000 0.150955 O\n0.000000 0.000000 0.849045 O\n-0.000000 0.500000 0.370529 O\n-0.000000 0.500000 0.629471 O\n-0.000000 0.500000 -0.000000 O\n",
"nsites": 13,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Co",
"Cu",
"O"
],
"chemical_system": "Ba-Co-Cu-Nd-O",
"density": 6.5593666916229285,
"density_atomic": 0.0716287363018609,
"volume": 181.4914051424116,
"volume_molar": 8.40743683459839,
"formula_full": "Ba2 Nd1 Co1 Cu2 O7",
"formula_reduced": "Ba2NdCoCu2O7",
"formula_anonymous": "ABC2D2E7",
"energy_above_hull": 1.772387672307692,
"spacegroup": 47
},
{
"id": "jvasp-11719",
"created_at": "2022-09-04T14:38:14.167083Z",
"updated_at": "2022-09-04T14:38:14.167099Z",
"structure_string": "Li1 Co1 C4 O4\n1.0\n5.580355 0.000250 -0.000376\n0.000250 5.580302 0.000094\n-0.000376 0.000094 5.580352\nLi Co C O\n1 1 4 4\ndirect\n0.000011 0.999959 0.000023 Li\n0.499996 0.500024 0.499979 Co\n0.318721 0.681295 0.681262 C\n0.681270 0.681292 0.318710 C\n0.318713 0.318738 0.318705 C\n0.681280 0.318729 0.681275 C\n0.197227 0.802765 0.802788 O\n0.197217 0.197210 0.197231 O\n0.802783 0.802771 0.197227 O\n0.802773 0.197210 0.802792 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Co",
"C",
"O"
],
"chemical_system": "C-Co-Li-O",
"density": 1.7001199018974995,
"density_atomic": 0.05754649505647523,
"volume": 173.77252932930418,
"volume_molar": 10.46482631842298,
"formula_full": "Li1 Co1 C4 O4",
"formula_reduced": "LiCo(CO)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 4.437234490000001,
"spacegroup": 215
},
{
"id": "jvasp-117190",
"created_at": "2022-09-04T14:38:46.605268Z",
"updated_at": "2022-09-04T14:38:46.605296Z",
"structure_string": "Zn3 In2 O6\n1.0\n3.414695 -0.000346 13.815005\n1.681746 2.971846 13.815005\n-0.000594 -0.000346 14.230759\nZn In O\n3 2 6\ndirect\n0.262336 0.262335 0.262336 Zn\n0.738186 0.738184 0.738185 Zn\n0.131157 0.131157 0.131157 Zn\n0.000311 0.000311 0.000311 In\n0.863223 0.863220 0.863221 In\n0.915199 0.915196 0.915197 O\n0.083976 0.083976 0.083976 O\n0.195177 0.195176 0.195177 O\n0.810555 0.810553 0.810554 O\n0.308695 0.308694 0.308695 O\n0.691240 0.691237 0.691239 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Zn",
"In",
"O"
],
"chemical_system": "In-O-Zn",
"density": 5.998921517163145,
"density_atomic": 0.0761488339133818,
"volume": 144.45395201339971,
"volume_molar": 7.908382112390713,
"formula_full": "Zn3 In2 O6",
"formula_reduced": "Zn3In2O6",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 0.8176656490909088,
"spacegroup": 160
},
{
"id": "jvasp-117191",
"created_at": "2022-09-04T14:38:51.387285Z",
"updated_at": "2022-09-04T14:38:51.387311Z",
"structure_string": "Y1 Zr2 Co9\n1.0\n4.594606 0.000000 1.371539\n-2.502013 4.090411 0.000000\n-0.017561 -0.010742 8.440480\nY Zr Co\n1 2 9\ndirect\n0.278884 0.139442 0.581675 Y\n0.727889 0.863944 0.408168 Zr\n0.001068 0.000534 -0.001603 Zr\n0.659900 0.579581 0.760521 Co\n0.159162 0.579581 0.760521 Co\n0.659900 0.080319 0.760521 Co\n0.337662 0.419751 0.242587 Co\n0.839503 0.419751 0.242587 Co\n0.337663 0.917910 0.242587 Co\n0.665524 0.332761 0.001716 Co\n0.332648 0.666324 0.001029 Co\n0.000209 0.500104 0.499688 Co\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"Zr",
"Co"
],
"chemical_system": "Co-Y-Zr",
"density": 8.385647784815175,
"density_atomic": 0.07558374145808842,
"volume": 158.76430259348913,
"volume_molar": 7.9675081490102055,
"formula_full": "Y1 Zr2 Co9",
"formula_reduced": "YZr2Co9",
"formula_anonymous": "AB2C9",
"energy_above_hull": 4.158125212499999,
"spacegroup": 160
},
{
"id": "jvasp-117192",
"created_at": "2022-09-04T14:38:46.612152Z",
"updated_at": "2022-09-04T14:38:46.612171Z",
"structure_string": "Ti1 Nb2 Zn1 O8\n1.0\n5.756664 0.000000 0.000000\n0.000000 4.740111 0.128196\n-0.000000 0.006453 5.009123\nTi Nb Zn O\n1 2 1 8\ndirect\n0.170620 0.500000 0.500000 Ti\n0.808604 0.500000 0.000000 Nb\n0.314510 0.000000 -0.000000 Nb\n0.700520 -0.000000 0.500000 Zn\n0.901034 0.289206 0.684287 O\n0.608821 0.224690 0.161152 O\n0.608821 0.775309 0.838848 O\n0.901034 0.710794 0.315713 O\n0.117548 0.736078 0.818381 O\n0.375466 0.754509 0.320835 O\n0.375466 0.245490 0.679165 O\n0.117548 0.263921 0.181619 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Ti",
"Nb",
"Zn",
"O"
],
"chemical_system": "Nb-O-Ti-Zn",
"density": 5.188674180783389,
"density_atomic": 0.08779611283529411,
"volume": 136.6803109211914,
"volume_molar": 6.859233929066499,
"formula_full": "Ti1 Nb2 Zn1 O8",
"formula_reduced": "TiNb2ZnO8",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.0836946277777777,
"spacegroup": 3
}
]
}