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=1108",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=1106",
"results": [
{
"id": "jvasp-119124",
"created_at": "2022-09-04T14:38:51.186375Z",
"updated_at": "2022-09-04T14:38:51.186409Z",
"structure_string": "Y4 Ti2 Nb2 O15\n1.0\n6.325908 0.016264 -3.570057\n-2.084961 5.890121 -3.704334\n0.009822 -0.016264 7.263768\nY Ti Nb O\n4 2 2 15\ndirect\n0.255205 0.503487 0.248283 Y\n0.255205 0.006923 0.751718 Y\n0.257003 0.500368 0.756635 Y\n0.743734 0.500368 0.243365 Y\n0.761910 0.997945 0.236038 Ti\n0.761910 0.525872 0.763963 Ti\n0.760576 0.998090 0.762486 Nb\n0.235603 0.998090 0.237515 Nb\n0.420741 0.914987 0.097712 O\n0.817275 0.914987 0.494246 O\n0.420741 0.323029 0.505755 O\n0.818979 0.318979 0.500000 O\n0.421128 0.921128 0.500000 O\n0.637044 0.635948 0.538402 O\n0.653189 0.653189 -0.000000 O\n0.637044 0.098640 0.001095 O\n0.097546 0.635948 0.998905 O\n0.817275 0.323029 0.902288 O\n0.115453 0.115453 -0.000000 O\n0.380424 0.380424 -0.000000 O\n0.123290 0.623290 0.500000 O\n0.097546 0.098641 0.461598 O\n0.886182 0.886181 -0.000000 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Y",
"Ti",
"Nb",
"O"
],
"chemical_system": "Nb-O-Ti-Y",
"density": 5.382692226868615,
"density_atomic": 0.08499607941951536,
"volume": 270.600716610455,
"volume_molar": 7.085198283413173,
"formula_full": "Y4 Ti2 Nb2 O15",
"formula_reduced": "Y4Ti2Nb2O15",
"formula_anonymous": "A2B2C4D15",
"energy_above_hull": 3.528844772463768,
"spacegroup": 44
},
{
"id": "jvasp-119125",
"created_at": "2022-09-04T14:38:51.890045Z",
"updated_at": "2022-09-04T14:38:51.890060Z",
"structure_string": "Y4 Co16 B3 C1\n1.0\n4.941314 0.000000 0.000000\n-2.470657 4.279303 0.000000\n-0.000000 -0.000000 13.599392\nY Co B C\n4 16 3 1\ndirect\n0.333332 0.666666 0.748319 Y\n0.333332 0.666666 0.251681 Y\n0.333332 0.666666 0.500000 Y\n0.333332 0.666666 -0.000000 Y\n0.000000 0.000000 0.252371 Co\n0.000000 0.000000 0.747629 Co\n0.666666 0.333333 0.250637 Co\n0.666666 0.333333 0.749363 Co\n0.833489 0.666979 0.891038 Co\n0.831391 0.662784 0.396398 Co\n0.833489 0.166510 0.891038 Co\n0.831392 0.168607 0.396398 Co\n0.333020 0.166510 0.891038 Co\n0.337215 0.168607 0.396398 Co\n0.833489 0.666979 0.108962 Co\n0.831391 0.662784 0.603602 Co\n0.833489 0.166510 0.108962 Co\n0.831392 0.168607 0.603602 Co\n0.333020 0.166510 0.108962 Co\n0.337215 0.168607 0.603602 Co\n0.666666 0.333333 -0.000000 B\n0.000000 0.000000 0.500000 B\n0.000000 0.000000 0.000000 B\n0.666666 0.333333 0.500000 C\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Y",
"Co",
"B",
"C"
],
"chemical_system": "B-C-Co-Y",
"density": 7.75513837844984,
"density_atomic": 0.0834595922745616,
"volume": 287.5643092173981,
"volume_molar": 7.21563644858057,
"formula_full": "Y4 Co16 B3 C1",
"formula_reduced": "Y4Co16B3C",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 4.435575997916667,
"spacegroup": 187
},
{
"id": "jvasp-119127",
"created_at": "2022-09-04T14:38:35.167921Z",
"updated_at": "2022-09-04T14:38:35.167946Z",
"structure_string": "V3 Cr3 B8\n1.0\n2.955556 0.000000 0.000000\n0.000000 2.991580 0.000000\n-0.000000 0.000000 13.061576\nV Cr B\n3 3 8\ndirect\n0.000000 0.000000 0.810697 V\n0.500001 0.000000 0.001745 V\n-0.000000 0.500000 0.498641 V\n0.000000 0.000000 0.187097 Cr\n0.500001 0.500000 0.687769 Cr\n0.500001 0.500000 0.312901 Cr\n0.500001 0.000000 0.432007 B\n-0.000000 0.500000 0.935193 B\n-0.000000 0.500000 0.068409 B\n0.500001 0.000000 0.565269 B\n0.000000 0.000000 0.359610 B\n0.500001 0.500000 0.863406 B\n0.500001 0.500000 0.140803 B\n0.000000 0.000000 0.636454 B\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Cr",
"B"
],
"chemical_system": "B-Cr-V",
"density": 5.683834127825002,
"density_atomic": 0.12122512491883612,
"volume": 115.48761042212513,
"volume_molar": 4.967733185700576,
"formula_full": "V3 Cr3 B8",
"formula_reduced": "V3Cr3B8",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 5.539661819047619,
"spacegroup": 25
},
{
"id": "jvasp-119129",
"created_at": "2022-09-04T14:38:51.258539Z",
"updated_at": "2022-09-04T14:38:51.258560Z",
"structure_string": "U4 Cr7 Si1\n1.0\n5.120331 0.000000 0.000000\n-2.560165 4.434338 0.000000\n-0.000000 0.000000 8.009456\nU Cr Si\n4 7 1\ndirect\n0.333334 0.666667 0.417478 U\n0.666667 0.333334 0.582523 U\n0.666667 0.333334 0.923148 U\n0.333334 0.666667 0.076852 U\n0.829678 0.170322 0.250590 Cr\n0.829679 0.659357 0.250590 Cr\n0.340643 0.170322 0.250590 Cr\n0.170323 0.829679 0.749410 Cr\n0.170322 0.340643 0.749410 Cr\n0.659358 0.829679 0.749410 Cr\n0.000000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Cr",
"Si"
],
"chemical_system": "Cr-Si-U",
"density": 12.273676904254057,
"density_atomic": 0.06598593823464562,
"volume": 181.85692771887352,
"volume_molar": 9.126400140868352,
"formula_full": "U4 Cr7 Si1",
"formula_reduced": "U4Cr7Si",
"formula_anonymous": "AB4C7",
"energy_above_hull": 6.159950366666666,
"spacegroup": 164
},
{
"id": "jvasp-119130",
"created_at": "2022-09-04T14:38:48.674502Z",
"updated_at": "2022-09-04T14:38:48.674518Z",
"structure_string": "Ti2 Nb2 Ga2 O12\n1.0\n4.674016 -0.000000 0.000000\n0.000000 4.674016 0.000000\n-0.000000 -0.000000 9.079525\nTi Nb Ga O\n2 2 2 12\ndirect\n0.500000 0.500000 0.499702 Ti\n0.000000 0.000000 0.999702 Ti\n0.500000 0.500000 0.833398 Nb\n0.000000 0.000000 0.333397 Nb\n0.500000 0.500000 0.167536 Ga\n0.000000 0.000000 0.667537 Ga\n0.700157 0.700157 0.000132 O\n0.304029 0.304029 0.664220 O\n0.306177 0.306177 0.335331 O\n0.299844 0.299844 0.000132 O\n0.806177 0.193823 0.835331 O\n0.193823 0.806177 0.835331 O\n0.804030 0.195971 0.164219 O\n0.693824 0.693824 0.335331 O\n0.200156 0.799845 0.500133 O\n0.195971 0.804030 0.164219 O\n0.799845 0.200156 0.500133 O\n0.695972 0.695972 0.664220 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ti",
"Nb",
"Ga",
"O"
],
"chemical_system": "Ga-Nb-O-Ti",
"density": 5.131635764695828,
"density_atomic": 0.0907463125991264,
"volume": 198.35516710761956,
"volume_molar": 6.636237426641151,
"formula_full": "Ti2 Nb2 Ga2 O12",
"formula_reduced": "TiNbGaO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 2.7709890064814813,
"spacegroup": 102
},
{
"id": "jvasp-119131",
"created_at": "2022-09-04T14:38:35.242845Z",
"updated_at": "2022-09-04T14:38:35.242870Z",
"structure_string": "Tm2 B6 Rh9\n1.0\n5.575307 -0.000000 0.000000\n-2.787653 4.828358 0.000000\n-0.000000 -0.000000 8.573627\nTm B Rh\n2 6 9\ndirect\n0.000000 0.000000 0.705030 Tm\n0.000000 0.000000 0.294971 Tm\n0.666667 0.333333 -0.000000 B\n0.333334 0.666667 -0.000000 B\n0.666667 0.333333 0.667564 B\n0.333334 0.666667 0.667564 B\n0.333334 0.666667 0.332436 B\n0.666667 0.333333 0.332436 B\n0.500001 0.500000 0.500000 Rh\n0.000000 0.500000 0.164715 Rh\n0.500000 0.000000 0.164715 Rh\n0.500001 0.500000 0.835286 Rh\n0.000000 0.500000 0.835286 Rh\n0.500000 0.000000 0.835286 Rh\n0.500000 0.000000 0.500000 Rh\n0.500001 0.500000 0.164715 Rh\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Tm",
"B",
"Rh"
],
"chemical_system": "B-Rh-Tm",
"density": 9.560999785008331,
"density_atomic": 0.07365734932185107,
"volume": 230.79842210608587,
"volume_molar": 8.175885794757322,
"formula_full": "Tm2 B6 Rh9",
"formula_reduced": "Tm2(B2Rh3)3",
"formula_anonymous": "A2B6C9",
"energy_above_hull": 4.062055352941176,
"spacegroup": 191
},
{
"id": "jvasp-119132",
"created_at": "2022-09-04T14:38:48.746787Z",
"updated_at": "2022-09-04T14:38:48.746812Z",
"structure_string": "Tl2 Bi2 F8\n1.0\n3.818199 -0.000000 0.000000\n0.000000 6.509580 0.000000\n-0.000000 -0.000000 8.124104\nTl Bi F\n2 2 8\ndirect\n-0.000000 0.251761 0.373360 Tl\n-0.000000 0.751761 0.626640 Tl\n0.500000 0.762789 0.133183 Bi\n0.500000 0.262789 0.866817 Bi\n-0.000000 0.497540 0.913074 F\n-0.000000 0.997540 0.086925 F\n0.500000 0.440110 0.637429 F\n0.500000 0.940110 0.362570 F\n-0.000000 0.655248 0.270484 F\n-0.000000 0.155248 0.729516 F\n0.500000 0.392552 0.144890 F\n0.500000 0.892552 0.855110 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Bi",
"F"
],
"chemical_system": "Bi-F-Tl",
"density": 8.048559763812564,
"density_atomic": 0.05942842813857506,
"volume": 201.9235637869881,
"volume_molar": 10.133434365717344,
"formula_full": "Tl2 Bi2 F8",
"formula_reduced": "TlBiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0039449999999996,
"spacegroup": 26
},
{
"id": "jvasp-119133",
"created_at": "2022-09-04T14:38:35.284074Z",
"updated_at": "2022-09-04T14:38:35.284100Z",
"structure_string": "U1 Al6 Fe6\n1.0\n6.439920 -0.000018 -1.031701\n-1.568425 4.279024 -4.665509\n-0.019007 0.000018 6.522010\nU Al Fe\n1 6 6\ndirect\n0.000000 0.000000 0.000000 U\n0.651724 0.651723 -0.000001 Al\n0.348275 0.348275 -0.000000 Al\n0.342603 -0.000000 0.342603 Al\n0.657396 -0.000000 0.657397 Al\n0.199224 0.699225 0.499999 Al\n0.800774 0.300774 0.500000 Al\n0.499999 0.500000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.767863 0.499999 0.267863 Fe\n0.232136 0.500000 0.732136 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"U",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-U",
"density": 6.793986139804617,
"density_atomic": 0.07236666841264182,
"volume": 179.640714228721,
"volume_molar": 8.321705133171482,
"formula_full": "U1 Al6 Fe6",
"formula_reduced": "U(AlFe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 3.4444404461538456,
"spacegroup": 71
},
{
"id": "jvasp-119135",
"created_at": "2022-09-04T14:38:35.349421Z",
"updated_at": "2022-09-04T14:38:35.349447Z",
"structure_string": "Ti16 Cu8 O4\n1.0\n7.005890 -0.000000 4.044853\n2.335297 6.605217 4.044853\n-0.000000 -0.000000 8.089705\nTi Cu O\n16 8 4\ndirect\n0.070312 0.070312 0.429688 Ti\n0.833565 0.833566 0.833565 Ti\n0.499304 0.833566 0.833565 Ti\n0.833565 0.833566 0.499303 Ti\n0.816050 0.183950 0.183950 Ti\n0.183951 0.816050 0.183950 Ti\n0.816050 0.816050 0.183950 Ti\n0.183951 0.816050 0.816049 Ti\n0.833565 0.499304 0.833565 Ti\n0.183950 0.183950 0.816050 Ti\n0.429688 0.070312 0.070312 Ti\n0.070312 0.429689 0.070311 Ti\n0.429688 0.429689 0.070311 Ti\n0.070312 0.429689 0.429688 Ti\n0.429688 0.070312 0.429688 Ti\n0.816050 0.183950 0.816050 Ti\n0.413584 0.413584 0.413584 Cu\n0.759249 0.413584 0.413584 Cu\n0.413584 0.759249 0.413584 Cu\n0.413584 0.413584 0.759249 Cu\n0.139080 0.620307 0.620306 Cu\n0.620307 0.139080 0.620307 Cu\n0.620307 0.620307 0.139080 Cu\n0.620307 0.620307 0.620306 Cu\n0.626402 0.124533 0.124533 O\n0.124533 0.124533 0.626403 O\n0.124533 0.626403 0.124532 O\n0.124533 0.124533 0.124533 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ti",
"Cu",
"O"
],
"chemical_system": "Cu-O-Ti",
"density": 5.936073044766705,
"density_atomic": 0.07479540917010974,
"volume": 374.3545267105719,
"volume_molar": 8.051484478550872,
"formula_full": "Ti16 Cu8 O4",
"formula_reduced": "Ti4Cu2O",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.632476819047619,
"spacegroup": 216
},
{
"id": "jvasp-119136",
"created_at": "2022-09-04T14:38:35.359496Z",
"updated_at": "2022-09-04T14:38:35.359528Z",
"structure_string": "Ti2 Al2 Cr1 Cu1 S8\n1.0\n6.061794 0.000416 3.492797\n-4.058256 5.920420 0.000000\n-0.000000 0.000000 6.985593\nTi Al Cr Cu S\n2 2 1 1 8\ndirect\n0.024464 0.006740 0.464397 Ti\n0.024464 0.006740 0.011138 Ti\n0.237243 0.608703 0.631378 Al\n0.494979 0.497241 0.002511 Al\n0.474701 0.002863 0.012650 Cr\n0.749703 0.376445 0.375149 Cu\n0.006648 0.754093 0.246676 S\n0.013373 0.249507 0.243314 S\n0.498071 0.252516 0.768812 S\n0.498071 0.252516 0.233116 S\n0.973972 0.221735 0.763014 S\n0.987270 0.756085 0.756365 S\n0.508518 0.757410 0.229417 S\n0.508518 0.757410 0.762065 S\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Ti",
"Al",
"Cr",
"Cu",
"S"
],
"chemical_system": "Al-Cr-Cu-S-Ti",
"density": 3.455745851706123,
"density_atomic": 0.05584067212020487,
"volume": 250.71331465823047,
"volume_molar": 10.784506223414537,
"formula_full": "Ti2 Al2 Cr1 Cu1 S8",
"formula_reduced": "Ti2Al2CrCuS8",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.613890008333333,
"spacegroup": 8
},
{
"id": "jvasp-119137",
"created_at": "2022-09-04T14:38:50.250468Z",
"updated_at": "2022-09-04T14:38:50.250492Z",
"structure_string": "Sr2 Y2 Ga6 O14\n1.0\n7.973141 0.010787 0.000000\n-0.218658 7.970149 0.000000\n-0.000000 -0.000000 5.270879\nSr Y Ga O\n2 2 6 14\ndirect\n0.161836 0.838164 0.493082 Sr\n0.838164 0.161837 0.493082 Sr\n0.658994 0.658994 0.516600 Y\n0.341006 0.341006 0.516600 Y\n0.360075 0.639925 0.035157 Ga\n0.848636 0.848636 0.967084 Ga\n0.639924 0.360076 0.035157 Ga\n0.151364 0.151364 0.967084 Ga\n0.500000 0.000000 0.991563 Ga\n-0.000000 0.500000 0.991563 Ga\n0.836041 0.418408 0.207944 O\n0.345775 0.102005 0.778477 O\n0.102005 0.345775 0.778477 O\n0.581592 0.163959 0.207944 O\n0.897995 0.654225 0.778477 O\n0.418408 0.836042 0.207944 O\n0.500000 0.500000 0.221869 O\n0.623798 0.376202 0.689900 O\n0.839569 0.839570 0.309813 O\n0.376202 0.623798 0.689900 O\n0.654225 0.897996 0.778477 O\n0.000000 0.000000 0.826055 O\n0.160430 0.160431 0.309813 O\n0.163959 0.581592 0.207944 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sr",
"Y",
"Ga",
"O"
],
"chemical_system": "Ga-O-Sr-Y",
"density": 4.934504214511621,
"density_atomic": 0.07164999938223841,
"volume": 334.9616218691755,
"volume_molar": 8.40494181705862,
"formula_full": "Sr2 Y2 Ga6 O14",
"formula_reduced": "SrYGa3O7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.601115269583333,
"spacegroup": 35
},
{
"id": "jvasp-119138",
"created_at": "2022-09-04T14:38:53.073856Z",
"updated_at": "2022-09-04T14:38:53.073882Z",
"structure_string": "Tb2 Ti2 Fe22 H1\n1.0\n4.692073 -0.000000 -0.000000\n-2.346036 5.929125 -0.007380\n-0.000000 -0.001591 11.856947\nTb Ti Fe H\n2 2 22 1\ndirect\n0.002868 0.005736 0.002763 Tb\n0.502652 0.005306 0.502779 Tb\n0.312908 0.625818 0.313914 Ti\n0.814405 0.628813 0.813427 Ti\n0.175925 0.351852 0.176155 Fe\n0.322756 0.645513 0.679275 Fe\n0.821079 0.642160 0.178888 Fe\n0.179874 0.359750 0.822079 Fe\n0.678230 0.356462 0.321717 Fe\n0.500236 0.501178 0.001180 Fe\n-0.000210 0.500763 0.501432 Fe\n0.000941 0.501178 0.001180 Fe\n0.500973 0.500763 0.501432 Fe\n0.252082 0.003789 0.749564 Fe\n0.751707 0.003789 0.749564 Fe\n0.676720 0.353441 0.676576 Fe\n0.250015 0.001423 0.251407 Fe\n0.116967 0.233934 0.616179 Fe\n0.614560 0.229121 0.115324 Fe\n0.387126 0.774254 0.886222 Fe\n0.885301 0.770603 0.386174 Fe\n0.610278 0.220557 0.888786 Fe\n0.108701 0.217404 0.391178 Fe\n0.890840 0.781683 0.608738 Fe\n0.389109 0.778219 0.110290 Fe\n0.751407 0.001423 0.251407 Fe\n0.502539 0.005078 0.002367 H\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Tb",
"Ti",
"Fe",
"H"
],
"chemical_system": "Fe-H-Tb-Ti",
"density": 8.271928325665284,
"density_atomic": 0.081853186586554,
"volume": 329.8588744794853,
"volume_molar": 7.357246566854194,
"formula_full": "Tb2 Ti2 Fe22 H1",
"formula_reduced": "Tb2Ti2Fe22H",
"formula_anonymous": "AB2C2D22",
"energy_above_hull": 4.203098683950617,
"spacegroup": 8
}
]
}