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=-nsites&page=1230",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=1228",
"results": [
{
"id": "jvasp-39906",
"created_at": "2022-09-04T14:37:49.248621Z",
"updated_at": "2022-09-04T14:37:49.248641Z",
"structure_string": "Y3 Al7 Cu2\n1.0\n5.510122 0.000000 -0.000000\n2.755061 -4.771906 0.000000\n0.000000 3.181270 -8.491217\nY Al Cu\n3 7 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.858294 0.283412 0.425117 Y\n0.141705 0.716591 0.574885 Y\n0.418323 0.163353 0.235500 Al\n0.418323 0.653826 0.235500 Al\n0.927851 0.653826 0.235500 Al\n0.500000 1.000000 0.500000 Al\n0.072149 0.346176 0.764499 Al\n0.581676 0.346176 0.764499 Al\n0.581677 0.836648 0.764499 Al\n0.664587 0.670826 0.006239 Cu\n0.335414 0.329173 0.993761 Cu\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Y",
"density": 4.333675742768002,
"density_atomic": 0.05374749296054645,
"volume": 223.2662276696077,
"volume_molar": 11.20450541650487,
"formula_full": "Y3 Al7 Cu2",
"formula_reduced": "Y3Al7Cu2",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 1.959943904166667,
"spacegroup": 166
},
{
"id": "jvasp-23340",
"created_at": "2022-09-04T14:37:50.512010Z",
"updated_at": "2022-09-04T14:37:50.512029Z",
"structure_string": "Dy4 Si4 Ru4\n1.0\n4.357391 0.000000 0.000000\n-0.000000 6.998604 0.000000\n0.000000 0.000000 7.081833\nDy Si Ru\n4 4 4\ndirect\n0.250000 0.983761 0.813912 Dy\n0.750000 0.016238 0.186087 Dy\n0.250000 0.483762 0.686087 Dy\n0.750000 0.516238 0.313912 Dy\n0.250000 0.304465 0.106385 Si\n0.750000 0.695535 0.893615 Si\n0.250000 0.804465 0.393615 Si\n0.750000 0.195535 0.606385 Si\n0.750000 0.846178 0.567441 Ru\n0.250000 0.153822 0.432559 Ru\n0.750000 0.346178 0.932558 Ru\n0.250000 0.653821 0.067441 Ru\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Dy",
"Si",
"Ru"
],
"chemical_system": "Dy-Ru-Si",
"density": 8.970065732450642,
"density_atomic": 0.05556452577023724,
"volume": 215.9651294356537,
"volume_molar": 10.838103405942714,
"formula_full": "Dy4 Si4 Ru4",
"formula_reduced": "DySiRu",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4087618666666666,
"spacegroup": 62
},
{
"id": "jvasp-58233",
"created_at": "2022-09-04T14:37:35.492366Z",
"updated_at": "2022-09-04T14:37:35.492398Z",
"structure_string": "Nb8 Co2 Si2\n1.0\n6.223362 0.000000 0.000000\n0.000000 6.223362 -0.000000\n0.000000 0.000000 5.032749\nNb Co Si\n8 2 2\ndirect\n0.333121 0.151287 0.500000 Nb\n0.666878 0.848713 0.500000 Nb\n0.151287 0.666878 0.500000 Nb\n0.848713 0.333121 0.500000 Nb\n0.333121 0.848713 0.000000 Nb\n0.848713 0.666878 0.000000 Nb\n0.151287 0.333121 0.000000 Nb\n0.666878 0.151287 0.000000 Nb\n0.000000 0.000000 0.750000 Co\n0.000000 0.000000 0.250000 Co\n0.500000 0.500000 0.750000 Si\n0.500000 0.500000 0.250000 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Co",
"Si"
],
"chemical_system": "Co-Nb-Si",
"density": 7.8144715514539556,
"density_atomic": 0.061563860777096045,
"volume": 194.9195493675801,
"volume_molar": 9.781941359727801,
"formula_full": "Nb8 Co2 Si2",
"formula_reduced": "Nb4CoSi",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.196412850000001,
"spacegroup": 124
},
{
"id": "jvasp-26635",
"created_at": "2022-09-04T14:37:41.892089Z",
"updated_at": "2022-09-04T14:37:41.892105Z",
"structure_string": "Rb2 Sb2 Br2 F6\n1.0\n4.415251 -0.009793 -0.056299\n-1.799316 7.415549 -0.012300\n-1.485996 -3.543253 8.092635\nRb Sb Br F\n2 2 2 6\ndirect\n0.983132 0.305839 0.648997 Rb\n0.016866 0.694162 0.351003 Rb\n0.305997 0.159447 0.207918 Sb\n0.694002 0.840554 0.792083 Sb\n0.429995 0.761360 0.064769 Br\n0.570003 0.238641 0.935232 Br\n0.597600 0.549680 0.677720 F\n0.695665 0.885740 0.583031 F\n0.304333 0.114261 0.416970 F\n0.402398 0.450321 0.322280 F\n0.211087 0.762997 0.698131 F\n0.788912 0.237004 0.301869 F\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Br",
"F"
],
"chemical_system": "Br-F-Rb-Sb",
"density": 4.334800700713292,
"density_atomic": 0.04551478832005636,
"volume": 263.65057254835415,
"volume_molar": 13.23117382783984,
"formula_full": "Rb2 Sb2 Br2 F6",
"formula_reduced": "RbSbBrF3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-23377",
"created_at": "2022-09-04T14:37:35.882156Z",
"updated_at": "2022-09-04T14:37:35.882169Z",
"structure_string": "Zr4 Mn4 P4\n1.0\n3.808388 -0.000000 0.000000\n0.000000 6.279185 0.000000\n0.000000 0.000000 7.222657\nZr Mn P\n4 4 4\ndirect\n0.250000 0.516363 0.684311 Zr\n0.250000 0.016363 0.815690 Zr\n0.750000 0.983638 0.184310 Zr\n0.750000 0.483638 0.315690 Zr\n0.750000 0.348605 0.938242 Mn\n0.250000 0.151395 0.438242 Mn\n0.750000 0.848606 0.561759 Mn\n0.250000 0.651396 0.061758 Mn\n0.250000 0.285805 0.116359 P\n0.250000 0.785805 0.383642 P\n0.750000 0.714196 0.883642 P\n0.750000 0.214196 0.616359 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"Mn",
"P"
],
"chemical_system": "Mn-P-Zr",
"density": 6.811989837967162,
"density_atomic": 0.06947679698792537,
"volume": 172.71953400623124,
"volume_molar": 8.667844548226094,
"formula_full": "Zr4 Mn4 P4",
"formula_reduced": "ZrMnP",
"formula_anonymous": "ABC",
"energy_above_hull": 3.087795747126437,
"spacegroup": 62
},
{
"id": "jvasp-23556",
"created_at": "2022-09-04T14:37:34.508281Z",
"updated_at": "2022-09-04T14:37:34.508314Z",
"structure_string": "Ti4 Co4 Si4\n1.0\n3.724126 -0.000000 0.000000\n-0.000000 6.134619 0.000000\n0.000000 0.000000 6.890021\nTi Co Si\n4 4 4\ndirect\n0.250000 0.014205 0.807234 Ti\n0.750001 0.485795 0.307234 Ti\n0.250000 0.514206 0.692765 Ti\n0.750001 0.985795 0.192765 Ti\n0.250000 0.645589 0.066691 Co\n0.750001 0.354411 0.933309 Co\n0.250000 0.145589 0.433309 Co\n0.750001 0.854411 0.566691 Co\n0.750001 0.727503 0.887744 Si\n0.250000 0.772497 0.387744 Si\n0.750001 0.227503 0.612256 Si\n0.250000 0.272497 0.112256 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"Co",
"Si"
],
"chemical_system": "Co-Si-Ti",
"density": 5.691706218693224,
"density_atomic": 0.07623400544894642,
"volume": 157.41006824095513,
"volume_molar": 7.899546566568644,
"formula_full": "Ti4 Co4 Si4",
"formula_reduced": "TiCoSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7769526111111107,
"spacegroup": 62
},
{
"id": "jvasp-10101",
"created_at": "2022-09-04T14:37:50.485624Z",
"updated_at": "2022-09-04T14:37:50.485645Z",
"structure_string": "Na4 Zr2 Se6\n1.0\n6.584264 -0.000000 2.238597\n3.292132 6.031461 1.119299\n0.013231 -0.000000 7.236977\nNa Zr Se\n4 2 6\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.500001 Na\n0.157470 0.685058 0.500001 Na\n0.842529 0.314942 0.500001 Na\n0.668667 0.662664 0.000001 Zr\n0.331332 0.337336 0.000000 Zr\n0.434796 0.641516 0.773290 Se\n0.282440 0.000000 0.224639 Se\n0.565203 0.358484 0.226712 Se\n0.923686 0.641516 0.226712 Se\n0.076313 0.358484 0.773289 Se\n0.717559 0.000000 0.775363 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Zr",
"Se"
],
"chemical_system": "Na-Se-Zr",
"density": 4.325444815928597,
"density_atomic": 0.041779605123081015,
"volume": 287.22147958671434,
"volume_molar": 14.414068161388837,
"formula_full": "Na4 Zr2 Se6",
"formula_reduced": "Na2ZrSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.0754671000000005,
"spacegroup": 12
},
{
"id": "jvasp-28985",
"created_at": "2022-09-04T14:37:40.424455Z",
"updated_at": "2022-09-04T14:37:40.424481Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.346383 0.000000 0.000000\n-1.673191 2.898356 0.000886\n0.000000 0.011349 38.429389\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.667182 0.334365 0.420163 Te\n0.666771 0.333541 0.519055 Te\n0.333603 0.667206 0.469631 Mo\n0.667229 0.334458 0.280847 Mo\n0.333837 0.667675 0.093759 W\n0.665374 0.330747 0.658723 W\n0.333697 0.667395 0.324195 Se\n0.331793 0.663586 0.702155 Se\n0.334029 0.668061 0.237439 Se\n0.332096 0.664194 0.615137 Se\n0.667349 0.334699 0.054197 S\n0.667040 0.334082 0.133448 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.322651758983572,
"density_atomic": 0.032195148480548164,
"volume": 372.7269655939069,
"volume_molar": 18.705118765451537,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.5281584000000006,
"spacegroup": 156
},
{
"id": "jvasp-29210",
"created_at": "2022-09-04T14:37:41.086755Z",
"updated_at": "2022-09-04T14:37:41.086780Z",
"structure_string": "Te2 Mo2 W2 Se6\n1.0\n3.386453 0.000001 -0.000013\n-1.693226 2.932755 -0.000006\n-0.000138 -0.000177 36.159863\nTe Mo W Se\n2 2 2 6\ndirect\n0.666661 0.333374 0.416165 Te\n0.666666 0.333364 0.520874 Te\n0.333333 0.666635 0.096707 Mo\n0.666616 0.333305 0.277163 Mo\n0.333331 0.666703 0.468522 W\n0.666717 0.333362 0.660521 W\n0.333289 0.666643 0.322923 Se\n0.333389 0.666697 0.706415 Se\n0.666654 0.333285 0.051025 Se\n0.666676 0.333315 0.142449 Se\n0.333278 0.666636 0.231435 Se\n0.333374 0.666683 0.614550 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 5.957891289496935,
"density_atomic": 0.03341439169639049,
"volume": 359.1266933432241,
"volume_molar": 18.022595816552087,
"formula_full": "Te2 Mo2 W2 Se6",
"formula_reduced": "TeMoWSe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.447865627777778,
"spacegroup": 156
},
{
"id": "jvasp-28686",
"created_at": "2022-09-04T14:37:49.229395Z",
"updated_at": "2022-09-04T14:37:49.229422Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.348116 0.000000 0.000000\n-1.674058 2.899548 -0.000307\n0.000000 -0.003783 35.741665\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.333333 0.666666 0.332459 Te\n0.333190 0.666381 0.226051 Te\n0.333061 0.666122 0.091608 Mo\n0.333480 0.666960 0.473988 Mo\n0.666596 0.333190 0.279282 Mo\n0.666868 0.333736 0.658064 W\n0.333606 0.667212 0.704879 Se\n0.666764 0.333526 0.427341 Se\n0.666868 0.333732 0.520608 Se\n0.333461 0.666923 0.611196 Se\n0.666341 0.332680 0.049187 S\n0.666441 0.332881 0.134086 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.296932582692089,
"density_atomic": 0.03458403579978029,
"volume": 346.98090383298285,
"volume_molar": 17.41306536595205,
"formula_full": "Te2 Mo3 W1 Se4 S2",
"formula_reduced": "Te2Mo3W(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.723919725000001,
"spacegroup": 156
},
{
"id": "jvasp-23501",
"created_at": "2022-09-04T14:37:35.823792Z",
"updated_at": "2022-09-04T14:37:35.823810Z",
"structure_string": "Tm4 Ge4 Ru4\n1.0\n4.383496 0.000000 0.000000\n0.000000 6.925172 0.000000\n0.000000 0.000000 7.226842\nTm Ge Ru\n4 4 4\ndirect\n0.250000 0.988257 0.807374 Tm\n0.750001 0.011743 0.192625 Tm\n0.250000 0.488257 0.692625 Tm\n0.750001 0.511742 0.307375 Tm\n0.250000 0.293772 0.107122 Ge\n0.750001 0.706228 0.892878 Ge\n0.250000 0.793772 0.392878 Ge\n0.750001 0.206228 0.607122 Ge\n0.750001 0.842398 0.562220 Ru\n0.250000 0.157602 0.437780 Ru\n0.750001 0.342398 0.937780 Ru\n0.250000 0.657602 0.062220 Ru\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tm",
"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Tm",
"density": 10.374155356933718,
"density_atomic": 0.0546992670739886,
"volume": 219.38136728172753,
"volume_molar": 11.00954561576518,
"formula_full": "Tm4 Ge4 Ru4",
"formula_reduced": "TmGeRu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7262635666666666,
"spacegroup": 62
},
{
"id": "jvasp-37268",
"created_at": "2022-09-04T14:37:58.836668Z",
"updated_at": "2022-09-04T14:37:58.836694Z",
"structure_string": "Si6 Mo2 Pt4\n1.0\n3.524225 0.000000 0.000000\n0.000000 5.560296 0.000000\n0.000000 0.000000 9.288292\nSi Mo Pt\n6 2 4\ndirect\n0.499999 0.826447 0.434994 Si\n0.499999 0.814281 0.777322 Si\n0.000000 0.657117 0.126488 Si\n0.499999 0.326447 0.565006 Si\n0.499999 0.314281 0.222678 Si\n0.000000 0.157116 0.873512 Si\n0.000000 -0.001125 0.605283 Mo\n0.000000 0.498875 0.394717 Mo\n0.000000 -0.001153 0.285795 Pt\n0.499999 0.003134 0.029196 Pt\n0.000000 0.498848 0.714205 Pt\n0.499999 0.503134 0.970803 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Si",
"Mo",
"Pt"
],
"chemical_system": "Mo-Pt-Si",
"density": 10.407206706935531,
"density_atomic": 0.06593011703488612,
"volume": 182.01090093091062,
"volume_molar": 9.13412721050299,
"formula_full": "Si6 Mo2 Pt4",
"formula_reduced": "Si3MoPt2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.724365750000001,
"spacegroup": 26
}
]
}