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=volume&page=4088",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=4086",
"results": [
{
"id": "jvasp-122464",
"created_at": "2022-09-04T14:38:50.386520Z",
"updated_at": "2022-09-04T14:38:50.386549Z",
"structure_string": "Sr7 Ca1 Ir2 O12\n1.0\n6.867260 0.013857 -0.100282\n-0.101959 6.866517 -0.100282\n0.013625 0.013857 6.867979\nSr Ca Ir O\n7 1 2 12\ndirect\n0.136001 0.864000 0.500000 Sr\n0.500001 0.136001 0.864000 Sr\n0.864000 0.500001 0.136001 Sr\n0.000000 0.365998 0.634003 Sr\n0.634003 0.000000 0.365998 Sr\n0.365997 0.634003 0.000000 Sr\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500001 0.500000 Ca\n0.746400 0.746401 0.746400 Ir\n0.253600 0.253601 0.253600 Ir\n0.332407 0.200813 0.539872 O\n0.689941 0.823492 0.033678 O\n0.823491 0.033679 0.689941 O\n0.033678 0.689942 0.823491 O\n0.310059 0.966323 0.176509 O\n0.460128 0.799188 0.667594 O\n0.176510 0.310059 0.966322 O\n0.799188 0.667595 0.460128 O\n0.667594 0.460129 0.799188 O\n0.539872 0.332407 0.200813 O\n0.966322 0.176510 0.310059 O\n0.200813 0.539873 0.332406 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ir",
"O"
],
"chemical_system": "Ca-Ir-O-Sr",
"density": 6.305389281102303,
"density_atomic": 0.06792586510357587,
"volume": 323.8825146570248,
"volume_molar": 8.865754968033484,
"formula_full": "Sr7 Ca1 Ir2 O12",
"formula_reduced": "Sr7Ca(IrO6)2",
"formula_anonymous": "AB2C7D12",
"energy_above_hull": 1.8342081268181816,
"spacegroup": 155
},
{
"id": "jvasp-111205",
"created_at": "2022-09-04T14:38:49.002203Z",
"updated_at": "2022-09-04T14:38:49.002234Z",
"structure_string": "Na2 Cu1 Bi1 Br6\n1.0\n6.675761 -0.000000 3.854253\n2.225254 6.293968 3.854253\n-0.000000 0.000000 7.708505\nNa Cu Bi Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Bi\n0.738420 0.261580 0.261580 Br\n0.261580 0.261580 0.738420 Br\n0.261580 0.738420 0.738420 Br\n0.261580 0.738420 0.261580 Br\n0.738420 0.261580 0.738420 Br\n0.738419 0.738420 0.261580 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Cu",
"Bi",
"Br"
],
"chemical_system": "Bi-Br-Cu-Na",
"density": 4.090895527306847,
"density_atomic": 0.030874826871228403,
"volume": 323.8884558513521,
"volume_molar": 19.50501871675888,
"formula_full": "Na2 Cu1 Bi1 Br6",
"formula_reduced": "Na2CuBiBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-59580",
"created_at": "2022-09-04T14:36:51.784291Z",
"updated_at": "2022-09-04T14:36:51.784321Z",
"structure_string": "Ba5 V5 O15\n1.0\n2.843582 -4.925229 0.000000\n2.843582 4.925229 -0.000000\n0.000000 -0.000000 11.563315\nBa V O\n5 5 15\ndirect\n0.333333 0.666667 0.407012 Ba\n0.666667 0.333333 0.592988 Ba\n0.333333 0.666667 0.790204 Ba\n0.666667 0.333333 0.209796 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 V\n0.333333 0.666667 0.092820 V\n0.666667 0.333333 0.907180 V\n0.000000 0.000000 0.720446 V\n0.000000 0.000000 0.279553 V\n0.833297 0.666595 0.804933 O\n0.500000 0.500000 0.000000 O\n0.500000 -0.000000 0.000000 O\n0.833298 0.166702 0.804933 O\n0.166702 0.833298 0.195066 O\n0.166702 0.333404 0.195066 O\n0.151892 0.848107 0.604283 O\n0.303786 0.151892 0.395717 O\n0.848107 0.696214 0.395717 O\n0.848107 0.151892 0.395717 O\n0.333404 0.166702 0.804933 O\n0.151892 0.303786 0.604283 O\n0.696214 0.848107 0.604283 O\n0.666595 0.833297 0.195066 O\n-0.000000 0.500000 0.000000 O\n",
"nsites": 25,
"nelements": 3,
"elements": [
"Ba",
"V",
"O"
],
"chemical_system": "Ba-O-V",
"density": 6.056435279246112,
"density_atomic": 0.07718545560600412,
"volume": 323.8952183895031,
"volume_molar": 7.802170386530113,
"formula_full": "Ba5 V5 O15",
"formula_reduced": "BaVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.833360134,
"spacegroup": 164
},
{
"id": "jvasp-103642",
"created_at": "2022-09-04T14:36:50.192330Z",
"updated_at": "2022-09-04T14:36:50.192345Z",
"structure_string": "Ca2 Tl2 Br6\n1.0\n7.314471 0.040535 0.000000\n-6.101615 4.034034 0.000000\n-0.000000 -0.000000 10.886444\nCa Tl Br\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.256103 0.743895 0.250000 Tl\n0.743895 0.256103 0.750000 Tl\n0.636574 0.363424 0.049260 Br\n0.363424 0.636574 0.950739 Br\n0.363424 0.636574 0.549260 Br\n0.636574 0.363424 0.450740 Br\n0.935046 0.064951 0.250000 Br\n0.064952 0.935046 0.750000 Br\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"Tl",
"Br"
],
"chemical_system": "Br-Ca-Tl",
"density": 4.964165876557798,
"density_atomic": 0.030872113017127223,
"volume": 323.91692769627406,
"volume_molar": 19.506733331337045,
"formula_full": "Ca2 Tl2 Br6",
"formula_reduced": "CaTlBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-46077",
"created_at": "2022-09-04T14:38:17.155828Z",
"updated_at": "2022-09-04T14:38:17.155855Z",
"structure_string": "Dy4 Bi4 O14\n1.0\n-0.000000 5.450907 5.450907\n5.450907 0.000000 5.450907\n5.450907 5.450907 -0.000000\nDy Bi O\n4 4 14\ndirect\n0.500000 0.000000 0.500000 Dy\n0.500000 0.500000 0.000000 Dy\n0.000000 0.500000 0.500000 Dy\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Bi\n0.500000 0.000000 0.000000 Bi\n0.000000 0.500000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n0.894991 0.355010 0.894991 O\n0.625000 0.625000 0.625000 O\n0.894991 0.894991 0.355010 O\n0.355010 0.355010 0.894991 O\n0.355010 0.894991 0.355010 O\n0.644991 0.105010 0.644991 O\n0.105010 0.644991 0.105010 O\n0.105010 0.105010 0.644991 O\n0.644991 0.644991 0.105010 O\n0.105010 0.644991 0.644991 O\n0.894991 0.355010 0.355010 O\n0.644991 0.105010 0.105010 O\n0.375000 0.375000 0.375000 O\n0.355010 0.894991 0.894991 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Dy",
"Bi",
"O"
],
"chemical_system": "Bi-Dy-O",
"density": 8.765704971604116,
"density_atomic": 0.06791823133438786,
"volume": 323.9189179071146,
"volume_molar": 8.866751447561494,
"formula_full": "Dy4 Bi4 O14",
"formula_reduced": "Dy2Bi2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.1560205545454547,
"spacegroup": 227
},
{
"id": "jvasp-33815",
"created_at": "2022-09-04T14:38:05.035578Z",
"updated_at": "2022-09-04T14:38:05.035605Z",
"structure_string": "Mo2 I6\n1.0\n10.062848 0.000000 0.000000\n-5.031424 8.714681 0.000000\n-0.000000 -0.000000 3.694323\nMo I\n2 6\ndirect\n0.666667 0.333333 0.250001 Mo\n0.333333 0.666666 0.749998 Mo\n0.788690 0.211310 0.749998 I\n0.422622 0.211310 0.749998 I\n0.788689 0.577377 0.749998 I\n0.211310 0.788689 0.250001 I\n0.577378 0.788689 0.250001 I\n0.211311 0.422623 0.250001 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"I"
],
"chemical_system": "I-Mo",
"density": 4.8862369841496145,
"density_atomic": 0.024693503747669175,
"volume": 323.97184626969437,
"volume_molar": 24.387550756414754,
"formula_full": "Mo2 I6",
"formula_reduced": "MoI3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.27762618125,
"spacegroup": 194
},
{
"id": "jvasp-119067",
"created_at": "2022-09-04T14:38:51.522161Z",
"updated_at": "2022-09-04T14:38:51.522172Z",
"structure_string": "Y8 Os4 C8\n1.0\n5.123364 -0.000000 0.000000\n0.000000 6.460482 0.000000\n-0.000000 0.000000 9.787990\nY Os C\n8 4 8\ndirect\n0.250000 0.682892 0.552621 Y\n0.749999 0.317107 0.447379 Y\n0.749999 0.817107 0.052621 Y\n0.250000 0.182892 0.947379 Y\n0.250000 0.526474 0.218370 Y\n0.749999 0.473526 0.781630 Y\n0.749999 0.973526 0.718370 Y\n0.250000 0.026474 0.281630 Y\n0.250000 0.223077 0.634273 Os\n0.749999 0.776923 0.365727 Os\n0.749999 0.276923 0.134273 Os\n0.250000 0.723077 0.865727 Os\n0.250000 0.459219 0.757928 C\n0.749999 0.540781 0.242072 C\n0.749999 0.040781 0.257928 C\n0.250000 0.959219 0.742072 C\n0.250000 0.824912 0.053472 C\n0.749999 0.175088 0.946528 C\n0.749999 0.675087 0.553472 C\n0.250000 0.324912 0.446528 C\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Y",
"Os",
"C"
],
"chemical_system": "C-Os-Y",
"density": 8.038063045488052,
"density_atomic": 0.06173285258726406,
"volume": 323.976605029364,
"volume_molar": 9.75516359216877,
"formula_full": "Y8 Os4 C8",
"formula_reduced": "Y2OsC2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.97859918,
"spacegroup": 62
},
{
"id": "jvasp-112453",
"created_at": "2022-09-04T14:38:40.307730Z",
"updated_at": "2022-09-04T14:38:40.307759Z",
"structure_string": "Li3 V3 Si6 O18\n1.0\n7.126753 0.019796 1.507421\n-0.363694 6.434512 -3.439408\n-0.078561 0.046013 7.023319\nLi V Si O\n3 3 6 18\ndirect\n0.241817 0.760446 0.376443 Li\n0.500000 0.500000 0.500000 Li\n0.758184 0.239553 0.623557 Li\n0.226202 0.741840 0.953249 V\n0.500000 0.500000 -0.000000 V\n0.773798 0.258160 0.046750 V\n0.830944 0.709669 0.760086 Si\n0.842429 0.754136 0.322347 Si\n0.386309 0.018050 0.795083 Si\n0.157571 0.245864 0.677652 Si\n0.169056 0.290331 0.239914 Si\n0.613692 0.981950 0.204917 Si\n0.726467 0.959805 0.375749 O\n0.829511 0.752043 0.553217 O\n0.764610 0.932258 0.976158 O\n0.673270 0.523682 0.755295 O\n0.561454 0.192172 0.852857 O\n0.716359 0.555620 0.163677 O\n0.579533 0.220630 0.282622 O\n0.273533 0.040195 0.624250 O\n0.170489 0.247957 0.446783 O\n0.283641 0.444380 0.836322 O\n0.438547 0.807828 0.147142 O\n0.326730 0.476318 0.244705 O\n0.235390 0.067741 0.023841 O\n0.963385 0.333799 0.227656 O\n0.036615 0.666201 0.772344 O\n0.057426 0.770766 0.219315 O\n0.420468 0.779370 0.717378 O\n0.942574 0.229234 0.780685 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Li",
"V",
"Si",
"O"
],
"chemical_system": "Li-O-Si-V",
"density": 3.229691462291313,
"density_atomic": 0.09259540996691694,
"volume": 323.99014174372775,
"volume_molar": 6.503714128110269,
"formula_full": "Li3 V3 Si6 O18",
"formula_reduced": "LiV(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.8193362400000006,
"spacegroup": 2
},
{
"id": "jvasp-116851",
"created_at": "2022-09-04T14:38:51.929086Z",
"updated_at": "2022-09-04T14:38:51.929107Z",
"structure_string": "Sr6 W2 O12\n1.0\n6.868896 -0.014724 -0.207297\n-0.213204 6.865603 -0.207297\n-0.014304 -0.014724 6.872009\nSr W O\n6 2 12\ndirect\n0.064705 0.253756 0.563629 Sr\n0.436372 0.935295 0.746244 Sr\n0.746245 0.436372 0.935295 Sr\n0.253756 0.563629 0.064705 Sr\n0.563629 0.064705 0.253756 Sr\n0.935296 0.746245 0.436371 Sr\n0.500001 0.500000 0.500000 W\n0.000000 0.000000 0.000000 W\n0.546657 0.426270 0.228943 O\n0.270698 0.941724 0.068376 O\n0.771058 0.453344 0.573730 O\n0.573732 0.771057 0.453343 O\n0.426270 0.228944 0.546656 O\n0.058277 0.931623 0.729302 O\n0.729303 0.058277 0.931623 O\n0.453345 0.573731 0.771056 O\n0.941724 0.068378 0.270697 O\n0.068378 0.270698 0.941724 O\n0.228944 0.546657 0.426269 O\n0.931624 0.729303 0.058276 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sr",
"W",
"O"
],
"chemical_system": "O-Sr-W",
"density": 5.562524178551384,
"density_atomic": 0.06172567865885255,
"volume": 324.01425848286965,
"volume_molar": 9.756297364154324,
"formula_full": "Sr6 W2 O12",
"formula_reduced": "Sr3WO6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.180397993,
"spacegroup": 148
},
{
"id": "jvasp-104526",
"created_at": "2022-09-04T14:37:13.053844Z",
"updated_at": "2022-09-04T14:37:13.053860Z",
"structure_string": "Rb2 La1 Au1 Cl6\n1.0\n6.676731 -0.000000 3.854813\n2.225577 6.294883 3.854813\n-0.000000 -0.000000 7.709625\nRb La Au Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Au\n0.747930 0.252070 0.252070 Cl\n0.252070 0.252070 0.747930 Cl\n0.252070 0.747930 0.747930 Cl\n0.252070 0.747930 0.252070 Cl\n0.747930 0.252070 0.747930 Cl\n0.747930 0.747930 0.252070 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"La",
"Au",
"Cl"
],
"chemical_system": "Au-Cl-La-Rb",
"density": 3.6873178462353087,
"density_atomic": 0.03086137018748102,
"volume": 324.0296830390415,
"volume_molar": 19.513523616792927,
"formula_full": "Rb2 La1 Au1 Cl6",
"formula_reduced": "Rb2LaAuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-52141",
"created_at": "2022-09-04T14:37:13.683237Z",
"updated_at": "2022-09-04T14:37:13.683248Z",
"structure_string": "Sr2 Ce4 S8\n1.0\n7.494740 0.001454 -0.001609\n-2.496876 7.065049 0.001627\n-2.500247 -3.532308 6.119045\nSr Ce S\n2 4 8\ndirect\n0.125007 0.750000 0.874998 Sr\n0.374996 0.250000 0.625008 Sr\n0.249989 0.626377 0.376379 Ce\n0.623617 0.373616 0.250011 Ce\n0.750010 0.873616 0.123618 Ce\n0.876378 0.126377 0.749990 Ce\n0.990301 0.846834 0.491371 S\n0.991370 0.346833 0.490302 S\n0.508642 0.998951 0.355485 S\n0.143448 0.153158 0.144530 S\n0.356538 0.501064 0.009687 S\n0.509686 0.001064 0.856539 S\n0.644529 0.653158 0.643449 S\n0.855484 0.498951 0.008642 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Sr",
"Ce",
"S"
],
"chemical_system": "Ce-S-Sr",
"density": 5.084790270244096,
"density_atomic": 0.04320582031305295,
"volume": 324.0304176280261,
"volume_molar": 13.938262753411133,
"formula_full": "Sr2 Ce4 S8",
"formula_reduced": "Sr(CeS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.536348187142857,
"spacegroup": 122
},
{
"id": "jvasp-32414",
"created_at": "2022-09-04T14:38:06.006231Z",
"updated_at": "2022-09-04T14:38:06.006261Z",
"structure_string": "Si2 C2 Cl6 F6\n1.0\n6.082369 0.000704 0.225776\n0.210028 7.214111 1.662867\n-0.002320 0.090601 7.405702\nSi C Cl F\n2 2 6 6\ndirect\n0.677121 0.810614 0.810615 Si\n0.322880 0.189385 0.189386 Si\n0.249817 0.353217 0.353217 C\n0.750183 0.646782 0.646784 C\n0.344213 0.832378 0.832379 Cl\n0.191266 0.307303 0.940023 Cl\n0.808735 0.692696 0.059977 Cl\n0.808735 0.059976 0.692697 Cl\n0.655787 0.167621 0.167622 Cl\n0.191266 0.940023 0.307304 Cl\n0.669023 0.473622 0.713946 F\n0.669023 0.713945 0.473623 F\n0.026346 0.374774 0.374774 F\n0.330978 0.286054 0.526378 F\n0.973655 0.625226 0.625227 F\n0.330978 0.526377 0.286055 F\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Si",
"C",
"Cl",
"F"
],
"chemical_system": "C-Cl-F-Si",
"density": 2.0851289237031065,
"density_atomic": 0.049375923736166595,
"volume": 324.04457049743075,
"volume_molar": 12.196512600307946,
"formula_full": "Si2 C2 Cl6 F6",
"formula_reduced": "SiC(ClF)3",
"formula_anonymous": "ABC3D3",
"energy_above_hull": 1.14120895625,
"spacegroup": 12
}
]
}