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=created_at&page=645",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=643",
"results": [
{
"id": "jvasp-74905",
"created_at": "2022-09-04T14:36:02.115419Z",
"updated_at": "2022-09-04T14:36:02.115446Z",
"structure_string": "K2 Be1 Os1\n1.0\n-2.437601 2.437601 3.447463\n2.437601 -2.437601 3.447463\n2.437601 2.437601 -3.447463\nK Be Os\n2 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.750000 0.500000 K\n0.750000 0.250000 0.500000 Be\n0.499999 0.499999 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Os"
],
"chemical_system": "Be-K-Os",
"density": 5.622525357364087,
"density_atomic": 0.04881745644401942,
"volume": 81.93790277842376,
"volume_molar": 12.336039602771576,
"formula_full": "K2 Be1 Os1",
"formula_reduced": "K2BeOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.817831775,
"spacegroup": 216
},
{
"id": "jvasp-87878",
"created_at": "2022-09-04T14:36:02.119308Z",
"updated_at": "2022-09-04T14:36:02.119326Z",
"structure_string": "Ag8 Se4 O12\n1.0\n4.869070 -0.036609 0.000000\n-0.202460 7.319633 0.000000\n0.000000 0.000000 9.909127\nAg Se O\n8 4 12\ndirect\n0.763865 0.888073 0.753100 Ag\n0.236135 0.111927 0.246900 Ag\n0.763865 0.388073 0.746900 Ag\n0.752419 0.408435 0.440363 Ag\n0.752419 0.908434 0.059637 Ag\n0.247581 0.591565 0.559638 Ag\n0.247581 0.091565 0.940363 Ag\n0.236135 0.611926 0.253100 Ag\n0.272950 0.630867 0.894299 Se\n0.727050 0.369132 0.105701 Se\n0.727050 0.869132 0.394299 Se\n0.272950 0.130868 0.605701 Se\n0.212585 0.766916 0.753839 O\n0.367690 0.874352 0.381759 O\n0.632310 0.625647 0.881759 O\n0.632310 0.125647 0.618242 O\n0.752088 0.206942 0.978121 O\n0.752088 0.706942 0.521879 O\n0.247912 0.793057 0.021879 O\n0.212585 0.266916 0.746161 O\n0.787415 0.233084 0.246161 O\n0.787415 0.733083 0.253839 O\n0.367690 0.374353 0.118241 O\n0.247912 0.293058 0.478121 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ag",
"Se",
"O"
],
"chemical_system": "Ag-O-Se",
"density": 6.446677701604312,
"density_atomic": 0.067972125443758,
"volume": 353.0859134287078,
"volume_molar": 8.859721129336886,
"formula_full": "Ag8 Se4 O12",
"formula_reduced": "Ag2SeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4018780644444444,
"spacegroup": 14
},
{
"id": "jvasp-5506",
"created_at": "2022-09-04T14:36:02.120132Z",
"updated_at": "2022-09-04T14:36:02.120158Z",
"structure_string": "Au4 Se4 Cl28\n1.0\n0.000000 8.376473 0.032525\n9.991076 0.000000 0.000000\n0.000000 -3.859421 -11.602832\nAu Se Cl\n4 4 28\ndirect\n0.776453 0.079684 0.945292 Au\n0.223546 0.579685 0.554707 Au\n0.223546 0.920316 0.054707 Au\n0.776453 0.420316 0.445293 Au\n0.757104 0.705430 0.003014 Se\n0.242895 0.205430 0.496986 Se\n0.242895 0.294570 0.996986 Se\n0.757104 0.794570 0.503014 Se\n0.937541 0.252152 0.053253 Cl\n0.731796 0.299572 0.278188 Cl\n0.268204 0.799572 0.221811 Cl\n0.268204 0.700428 0.721811 Cl\n0.731796 0.200428 0.778188 Cl\n0.717076 0.950344 0.368755 Cl\n0.282924 0.049657 0.631244 Cl\n0.282924 0.450344 0.131244 Cl\n0.062459 0.752153 0.446746 Cl\n0.894393 0.911602 0.656592 Cl\n0.105607 0.411602 0.843407 Cl\n0.717076 0.549657 0.868755 Cl\n0.062459 0.747848 0.946746 Cl\n0.184595 0.040725 0.883445 Cl\n0.815405 0.959276 0.116555 Cl\n0.184595 0.459276 0.383445 Cl\n0.105607 0.088399 0.343408 Cl\n0.815405 0.540725 0.616554 Cl\n0.613753 0.907855 0.838330 Cl\n0.386247 0.407855 0.661669 Cl\n0.386246 0.092145 0.161670 Cl\n0.613753 0.592146 0.338330 Cl\n0.507794 0.810299 0.528872 Cl\n0.492205 0.310299 0.971127 Cl\n0.492205 0.189702 0.471127 Cl\n0.507794 0.689702 0.028872 Cl\n0.937541 0.247848 0.553253 Cl\n0.894393 0.588399 0.156592 Cl\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Au",
"Se",
"Cl"
],
"chemical_system": "Au-Cl-Se",
"density": 3.5895917135696482,
"density_atomic": 0.037121568712647025,
"volume": 969.7866024647575,
"volume_molar": 16.22275396445815,
"formula_full": "Au4 Se4 Cl28",
"formula_reduced": "AuSeCl7",
"formula_anonymous": "ABC7",
"energy_above_hull": 0.2960166010185184,
"spacegroup": 14
},
{
"id": "jvasp-92232",
"created_at": "2022-09-04T14:36:02.129112Z",
"updated_at": "2022-09-04T14:36:02.129139Z",
"structure_string": "Mg6 Pt2\n1.0\n4.602711 0.000000 -0.000000\n-2.301356 3.986066 0.000000\n0.000000 0.000000 8.334636\nMg Pt\n6 2\ndirect\n0.666667 0.333333 0.423242 Mg\n0.333333 0.666668 0.923242 Mg\n0.666667 0.333333 0.076759 Mg\n0.000000 0.000000 0.750000 Mg\n0.000000 0.000000 0.250000 Mg\n0.333333 0.666668 0.576759 Mg\n0.666667 0.333333 0.750000 Pt\n0.333333 0.666668 0.250000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Pt"
],
"chemical_system": "Mg-Pt",
"density": 5.820595737934658,
"density_atomic": 0.052317280068973335,
"volume": 152.91314818838194,
"volume_molar": 11.51080628056469,
"formula_full": "Mg6 Pt2",
"formula_reduced": "Mg3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 0.18713014,
"spacegroup": 194
},
{
"id": "jvasp-65546",
"created_at": "2022-09-04T14:36:02.130527Z",
"updated_at": "2022-09-04T14:36:02.130555Z",
"structure_string": "Ba1 Na2 In1\n1.0\n4.306113 0.000000 0.000000\n-0.000000 4.308640 0.000000\n0.000000 0.000000 7.811798\nBa Na In\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.694423 Na\n0.000000 0.000000 0.305577 Na\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"In"
],
"chemical_system": "Ba-In-Na",
"density": 3.4156250166229376,
"density_atomic": 0.027598365085870647,
"volume": 144.93612167076714,
"volume_molar": 21.820643147746154,
"formula_full": "Ba1 Na2 In1",
"formula_reduced": "BaNa2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-62761",
"created_at": "2022-09-04T14:36:02.132417Z",
"updated_at": "2022-09-04T14:36:02.132443Z",
"structure_string": "B8 Rh10\n1.0\n1.665629 -2.884954 0.000000\n1.665629 2.884954 0.000000\n0.000000 -0.000000 20.597579\nB Rh\n8 10\ndirect\n0.666667 0.333334 0.085616 B\n0.333334 0.666667 0.585616 B\n0.333334 0.666667 0.914384 B\n0.666667 0.333334 0.414384 B\n0.666667 0.333334 0.196305 B\n0.333334 0.666667 0.696305 B\n0.333334 0.666667 0.803695 B\n0.666667 0.333334 0.303695 B\n0.000000 0.000000 0.352357 Rh\n0.000000 0.000000 0.852357 Rh\n0.000000 0.000000 0.647643 Rh\n0.000000 0.000000 0.147643 Rh\n0.333334 0.666667 0.047319 Rh\n0.666667 0.333334 0.952681 Rh\n0.666667 0.333334 0.547319 Rh\n0.333334 0.666667 0.250000 Rh\n0.333334 0.666667 0.452681 Rh\n0.666667 0.333334 0.750000 Rh\n",
"nsites": 18,
"nelements": 2,
"elements": [
"B",
"Rh"
],
"chemical_system": "B-Rh",
"density": 9.35776368213874,
"density_atomic": 0.09093041344155633,
"volume": 197.95357041425015,
"volume_molar": 6.622801472106588,
"formula_full": "B8 Rh10",
"formula_reduced": "B4Rh5",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.220013925925926,
"spacegroup": 194
},
{
"id": "jvasp-73553",
"created_at": "2022-09-04T14:36:02.135139Z",
"updated_at": "2022-09-04T14:36:02.135154Z",
"structure_string": "Be2 Zn1 Rh1\n1.0\n2.874470 -0.000000 -0.000000\n0.000000 2.874470 -0.000000\n-0.000000 -0.000000 5.406999\nBe Zn Rh\n2 1 1\ndirect\n0.000000 0.000000 0.779803 Be\n0.000000 0.000000 0.220197 Be\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Rh"
],
"chemical_system": "Be-Rh-Zn",
"density": 6.925971353401482,
"density_atomic": 0.08953403172904441,
"volume": 44.67574979874853,
"volume_molar": 6.726091346165133,
"formula_full": "Be2 Zn1 Rh1",
"formula_reduced": "Be2ZnRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1649738999999997,
"spacegroup": 123
},
{
"id": "jvasp-69373",
"created_at": "2022-09-04T14:36:02.138167Z",
"updated_at": "2022-09-04T14:36:02.138195Z",
"structure_string": "Ba1 Mn1 Cr2\n1.0\n4.374142 0.000000 0.000000\n0.000000 4.374142 -0.000000\n0.000000 -0.000000 4.325434\nBa Mn Cr\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"Cr"
],
"chemical_system": "Ba-Cr-Mn",
"density": 5.944326181472165,
"density_atomic": 0.04833308836116335,
"volume": 82.75904014472378,
"volume_molar": 12.459664722850436,
"formula_full": "Ba1 Mn1 Cr2",
"formula_reduced": "BaMnCr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7881270028448273,
"spacegroup": 123
},
{
"id": "jvasp-70318",
"created_at": "2022-09-04T14:36:02.147889Z",
"updated_at": "2022-09-04T14:36:02.147918Z",
"structure_string": "Be2 Fe1 Pd1\n1.0\n2.720567 0.000000 -0.000000\n0.000000 2.720567 0.000000\n0.000000 0.000000 5.514848\nBe Fe Pd\n2 1 1\ndirect\n0.000000 0.000000 0.772310 Be\n0.000000 0.000000 0.227690 Be\n0.500001 0.500001 0.000000 Fe\n0.500001 0.500001 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Pd"
],
"chemical_system": "Be-Fe-Pd",
"density": 7.334437389003905,
"density_atomic": 0.09799582934299389,
"volume": 40.81806365452201,
"volume_molar": 6.1453031219542895,
"formula_full": "Be2 Fe1 Pd1",
"formula_reduced": "Be2FePd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.10882335,
"spacegroup": 123
},
{
"id": "jvasp-18660",
"created_at": "2022-09-04T14:36:02.148192Z",
"updated_at": "2022-09-04T14:36:02.148220Z",
"structure_string": "Ce1 Hg2\n1.0\n2.535585 -4.391764 -0.000000\n2.535585 4.391764 -0.000000\n-0.000000 -0.000000 3.333850\nCe Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333334 0.666668 0.500000 Hg\n0.666668 0.333334 0.500000 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ce",
"Hg"
],
"chemical_system": "Ce-Hg",
"density": 12.105721977152507,
"density_atomic": 0.0404043416761059,
"volume": 74.24944636021935,
"volume_molar": 14.904687244443688,
"formula_full": "Ce1 Hg2",
"formula_reduced": "CeHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-65019",
"created_at": "2022-09-04T14:36:02.149308Z",
"updated_at": "2022-09-04T14:36:02.149334Z",
"structure_string": "Be1 Mo4 Se1\n1.0\n0.000000 3.693098 3.693098\n3.693098 0.000000 3.693098\n3.693098 3.693098 -0.000000\nBe Mo Se\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.124013 0.625330 0.625330 Mo\n0.625330 0.625330 0.625330 Mo\n0.625330 0.124013 0.625330 Mo\n0.625330 0.625330 0.124013 Mo\n0.250000 0.250000 0.250000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Mo",
"Se"
],
"chemical_system": "Be-Mo-Se",
"density": 7.775746800079645,
"density_atomic": 0.05955918660692285,
"volume": 100.7401266172193,
"volume_molar": 10.111187044485288,
"formula_full": "Be1 Mo4 Se1",
"formula_reduced": "BeMo4Se",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.149892177777778,
"spacegroup": 216
},
{
"id": "jvasp-98108",
"created_at": "2022-09-04T14:36:02.150917Z",
"updated_at": "2022-09-04T14:36:02.150944Z",
"structure_string": "Rb2 Pr2 P6 H2 O20\n1.0\n6.835510 -0.006821 1.928812\n0.386454 7.367973 2.160738\n0.004015 0.011222 8.709748\nRb Pr P H O\n2 2 6 2 20\ndirect\n0.296887 0.303216 0.971959 Rb\n0.703113 0.696783 0.028041 Rb\n0.728551 0.633691 0.508658 Pr\n0.271449 0.366308 0.491342 Pr\n0.821856 0.298678 0.346198 P\n0.831685 0.227540 0.818437 P\n0.168315 0.772460 0.181564 P\n0.356882 0.964248 0.353510 P\n0.178144 0.701321 0.653802 P\n0.643119 0.035751 0.646491 P\n0.811589 0.186250 0.083338 H\n0.188411 0.813749 0.916662 H\n0.632557 0.421850 0.372298 O\n0.041743 0.640526 0.570818 O\n0.701803 0.394163 0.766786 O\n0.298197 0.605836 0.233214 O\n0.905994 0.288237 0.170918 O\n0.950290 0.749662 0.236271 O\n0.374739 0.166106 0.311513 O\n0.788279 0.064172 0.748582 O\n0.539002 0.843749 0.328904 O\n0.367443 0.578149 0.627703 O\n0.094006 0.711763 0.829082 O\n0.211721 0.935827 0.251418 O\n0.766766 0.091140 0.455624 O\n0.625261 0.833894 0.688488 O\n0.049710 0.250338 0.763729 O\n0.460998 0.156250 0.671096 O\n0.958257 0.359474 0.429182 O\n0.758324 0.133674 0.008200 O\n0.233234 0.908860 0.544376 O\n0.241675 0.866326 -0.008200 O\n",
"nsites": 32,
"nelements": 5,
"elements": [
"Rb",
"Pr",
"P",
"H",
"O"
],
"chemical_system": "H-O-P-Pr-Rb",
"density": 3.6379407480103776,
"density_atomic": 0.07298189185473979,
"volume": 438.4649285838124,
"volume_molar": 8.251554744547082,
"formula_full": "Rb2 Pr2 P6 H2 O20",
"formula_reduced": "RbPrP3HO10",
"formula_anonymous": "ABCD3E10",
"energy_above_hull": 2.678368834375,
"spacegroup": 2
}
]
}