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=formula_anonymous&page=4560",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4558",
"results": [
{
"id": "jvasp-34683",
"created_at": "2022-09-04T14:38:12.725511Z",
"updated_at": "2022-09-04T14:38:12.725538Z",
"structure_string": "K2 Sm2 Pd2 O6\n1.0\n3.933072 0.000000 0.000000\n-1.966536 6.387529 -1.662655\n0.000000 0.003629 7.361581\nK Sm Pd O\n2 2 2 6\ndirect\n0.355626 0.711252 0.436078 K\n0.644373 0.288748 0.563922 K\n0.350334 0.700671 0.922331 Sm\n0.649665 0.299329 0.077670 Sm\n0.006891 0.013782 0.770961 Pd\n0.993108 0.986219 0.229040 Pd\n0.830094 0.660191 0.133613 O\n0.847027 0.694056 0.722111 O\n0.169904 0.339809 0.866387 O\n0.493714 0.987430 0.190295 O\n0.506285 0.012571 0.809705 O\n0.152972 0.305944 0.277890 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Sm",
"Pd",
"O"
],
"chemical_system": "K-O-Pd-Sm",
"density": 6.17433217185833,
"density_atomic": 0.06487683360295383,
"volume": 184.9658704590916,
"volume_molar": 9.282420897504796,
"formula_full": "K2 Sm2 Pd2 O6",
"formula_reduced": "KSmPdO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.3931871791666666,
"spacegroup": 12
},
{
"id": "jvasp-46292",
"created_at": "2022-09-04T14:38:11.876647Z",
"updated_at": "2022-09-04T14:38:11.876677Z",
"structure_string": "Li2 Mn2 B2 O6\n1.0\n5.161043 -0.003019 -0.028621\n-2.539287 4.535444 0.015874\n-2.391102 -1.364656 5.267420\nLi Mn B O\n2 2 2 6\ndirect\n0.445351 0.376928 0.680356 Li\n0.554647 0.623070 0.319644 Li\n0.160716 0.747990 0.763994 Mn\n0.839282 0.252008 0.236006 Mn\n0.813763 0.075102 0.739883 B\n0.186235 0.924896 0.260116 B\n0.047997 0.311501 0.686783 O\n0.620447 0.127054 0.821647 O\n0.759997 0.787578 0.702415 O\n0.240001 0.212420 0.297584 O\n0.379551 0.872944 0.178353 O\n0.952001 0.688497 0.313216 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Mn",
"B",
"O"
],
"chemical_system": "B-Li-Mn-O",
"density": 3.2597261488576432,
"density_atomic": 0.09759291659725769,
"volume": 122.95974357976299,
"volume_molar": 6.170674030423658,
"formula_full": "Li2 Mn2 B2 O6",
"formula_reduced": "LiMnBO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.713261720785441,
"spacegroup": 2
},
{
"id": "jvasp-12114",
"created_at": "2022-09-04T14:38:17.091990Z",
"updated_at": "2022-09-04T14:38:17.092018Z",
"structure_string": "Sn4 P4 O12 F4\n1.0\n4.690486 0.054851 0.000000\n-0.944712 6.079343 0.000000\n0.000000 0.000000 12.554218\nSn P O F\n4 4 12 4\ndirect\n0.963468 0.731334 0.374299 Sn\n0.036533 0.268665 0.625701 Sn\n0.963468 0.231334 0.125701 Sn\n0.036533 0.768665 0.874299 Sn\n0.603647 0.163821 0.851854 P\n0.396354 0.336179 0.351853 P\n0.396354 0.836179 0.148147 P\n0.603647 0.663820 0.648147 P\n0.237562 0.477533 0.425149 O\n0.794823 0.802277 0.727658 O\n0.762439 0.522467 0.574851 O\n0.794823 0.302278 0.772343 O\n0.323680 0.046368 0.803914 O\n0.676321 0.453632 0.303914 O\n0.205178 0.197722 0.272343 O\n0.205178 0.697722 0.227658 O\n0.762439 0.022467 0.925149 O\n0.237562 0.977532 0.074851 O\n0.323680 0.546368 0.696087 O\n0.676321 0.953632 0.196086 O\n0.496278 0.156421 0.429724 F\n0.503723 0.843578 0.570277 F\n0.503723 0.343579 0.929724 F\n0.496278 0.656421 0.070276 F\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sn",
"P",
"O",
"F"
],
"chemical_system": "F-O-P-Sn",
"density": 4.013063157143164,
"density_atomic": 0.06692040932402255,
"volume": 358.634985087945,
"volume_molar": 8.99895984025044,
"formula_full": "Sn4 P4 O12 F4",
"formula_reduced": "SnPO3F",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.5749246637499996,
"spacegroup": 14
},
{
"id": "jvasp-29488",
"created_at": "2022-09-04T14:38:17.094320Z",
"updated_at": "2022-09-04T14:38:17.094331Z",
"structure_string": "Au4 Se4 Cl4 O12\n1.0\n4.189923 0.005270 0.117821\n0.390869 9.677312 1.665637\n0.092445 0.058945 10.675036\nAu Se Cl O\n4 4 4 12\ndirect\n0.006982 0.577249 0.189501 Au\n0.000000 0.000000 0.000000 Au\n0.993016 0.422751 0.810500 Au\n-0.000001 -0.000000 0.500000 Au\n0.694518 0.862237 0.275483 Se\n0.226910 0.714395 0.898792 Se\n0.773089 0.285604 0.101209 Se\n0.305481 0.137763 0.724518 Se\n0.276940 0.199312 0.433340 Cl\n0.723058 0.800687 0.566660 Cl\n0.346564 0.501422 0.649125 Cl\n0.653434 0.498577 0.350876 Cl\n0.374591 0.049679 0.878243 O\n0.625408 0.950321 0.121758 O\n0.653482 0.354610 0.948122 O\n0.035898 0.759349 0.249019 O\n0.087336 0.169872 0.070798 O\n0.070079 0.395848 0.129301 O\n0.912662 0.830127 0.929203 O\n0.346516 0.645389 0.051879 O\n0.964101 0.240650 0.750982 O\n0.918522 0.993740 0.317242 O\n0.929919 0.604152 0.870700 O\n0.081477 0.006259 0.682759 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Au",
"Se",
"Cl",
"O"
],
"chemical_system": "Au-Cl-O-Se",
"density": 5.521632907560738,
"density_atomic": 0.05551603934499917,
"volume": 432.3074967732167,
"volume_molar": 10.847569154881489,
"formula_full": "Au4 Se4 Cl4 O12",
"formula_reduced": "AuSeClO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.607540917361111,
"spacegroup": 2
},
{
"id": "jvasp-10077",
"created_at": "2022-09-04T14:38:06.665944Z",
"updated_at": "2022-09-04T14:38:06.665963Z",
"structure_string": "Zr2 Tl2 Cu2 S6\n1.0\n3.735856 0.000000 0.000000\n-1.867928 7.048835 0.000000\n0.000000 -0.000000 9.814151\nZr Tl Cu S\n2 2 2 6\ndirect\n0.000000 0.000000 0.500000 Zr\n0.000000 0.000000 0.000000 Zr\n0.255911 0.511824 0.250000 Tl\n0.744089 0.488176 0.750000 Tl\n0.460412 0.920825 0.750000 Cu\n0.539588 0.079175 0.250000 Cu\n0.376127 0.752253 0.549088 S\n0.623874 0.247746 0.450912 S\n0.623874 0.247746 0.049088 S\n0.061687 0.123374 0.750000 S\n0.938314 0.876625 0.250000 S\n0.376127 0.752253 0.950912 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Zr",
"Tl",
"Cu",
"S"
],
"chemical_system": "Cu-S-Tl-Zr",
"density": 5.851437955171302,
"density_atomic": 0.0464323899221221,
"volume": 258.4402831757484,
"volume_molar": 12.969698027821806,
"formula_full": "Zr2 Tl2 Cu2 S6",
"formula_reduced": "ZrTlCuS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.4675262583333335,
"spacegroup": 63
},
{
"id": "jvasp-28760",
"created_at": "2022-09-04T14:38:12.797590Z",
"updated_at": "2022-09-04T14:38:12.797601Z",
"structure_string": "Te2 Mo2 W2 S6\n1.0\n3.280338 -0.000000 -0.000000\n-1.640170 2.840941 0.000167\n-0.000000 0.002182 39.405945\nTe Mo W S\n2 2 2 6\ndirect\n0.666751 0.333501 0.419839 Te\n0.666484 0.332966 0.518439 Te\n0.333211 0.666420 0.093523 Mo\n0.666759 0.333517 0.280500 Mo\n0.333275 0.666550 0.469123 W\n0.666768 0.333536 0.659827 W\n0.333352 0.666706 0.319507 S\n0.333338 0.666679 0.698880 S\n0.666547 0.333093 0.054556 S\n0.666531 0.333062 0.132505 S\n0.333503 0.667007 0.241471 S\n0.333480 0.666961 0.620578 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.554080463839025,
"density_atomic": 0.032676737639972954,
"volume": 367.2337224178886,
"volume_molar": 18.429443068494106,
"formula_full": "Te2 Mo2 W2 S6",
"formula_reduced": "TeMoWS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.698693944444444,
"spacegroup": 156
},
{
"id": "jvasp-28952",
"created_at": "2022-09-04T14:38:12.923214Z",
"updated_at": "2022-09-04T14:38:12.923223Z",
"structure_string": "Te2 Mo2 W2 Se6\n1.0\n3.383636 0.000002 -0.000015\n-1.691817 2.930317 0.000077\n-0.000094 0.000804 35.929779\nTe Mo W Se\n2 2 2 6\ndirect\n0.666636 0.333355 0.417145 Te\n0.666608 0.333277 0.522007 Te\n0.333432 0.666487 0.094163 Mo\n0.333290 0.666651 0.469578 Mo\n0.666760 0.333325 0.276314 W\n0.666520 0.333536 0.662862 W\n0.333427 0.666653 0.322606 Se\n0.333170 0.666827 0.709079 Se\n0.666775 0.333183 0.048162 Se\n0.666757 0.333120 0.140217 Se\n0.333428 0.666675 0.230047 Se\n0.333199 0.666906 0.616565 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 6.0060276317397,
"density_atomic": 0.033684360803978394,
"volume": 356.248410644702,
"volume_molar": 17.87815062023898,
"formula_full": "Te2 Mo2 W2 Se6",
"formula_reduced": "TeMoWSe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.4448572944444447,
"spacegroup": 156
},
{
"id": "jvasp-102781",
"created_at": "2022-09-04T14:36:54.204756Z",
"updated_at": "2022-09-04T14:36:54.204764Z",
"structure_string": "Ce1 Si1 B1 Rh3\n1.0\n5.549305 0.000000 0.000000\n-2.774652 4.805840 0.000000\n-0.000000 -0.000000 3.410489\nCe Si B Rh\n1 1 1 3\ndirect\n0.333334 0.666667 -0.000000 Ce\n0.000000 0.000000 0.000000 Si\n0.666667 0.333333 -0.000000 B\n0.826273 0.652544 0.500000 Rh\n0.347457 0.173728 0.500000 Rh\n0.826273 0.173728 0.500000 Rh\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Ce",
"Si",
"B",
"Rh"
],
"chemical_system": "B-Ce-Rh-Si",
"density": 8.904368417924479,
"density_atomic": 0.06596699397842344,
"volume": 90.95457649567126,
"volume_molar": 9.12902104038533,
"formula_full": "Ce1 Si1 B1 Rh3",
"formula_reduced": "CeSiBRh3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.2891709472222224,
"spacegroup": 187
},
{
"id": "jvasp-107013",
"created_at": "2022-09-04T14:36:53.538064Z",
"updated_at": "2022-09-04T14:36:53.538085Z",
"structure_string": "Zr1 Sc1 Mn1 Ni3\n1.0\n4.283119 -0.000000 -2.479719\n-1.423741 4.039563 2.479719\n-0.023775 0.016829 4.897824\nZr Sc Mn Ni\n1 1 1 3\ndirect\n0.997323 0.002676 0.991971 Zr\n0.251248 0.748751 0.753745 Sc\n0.625198 0.374801 0.875595 Mn\n0.625020 0.374979 0.376228 Ni\n0.625020 0.873812 0.376228 Ni\n0.126187 0.374979 0.376228 Ni\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Zr",
"Sc",
"Mn",
"Ni"
],
"chemical_system": "Mn-Ni-Sc-Zr",
"density": 7.225831217859582,
"density_atomic": 0.07110325346811118,
"volume": 84.38432430790128,
"volume_molar": 8.469571315327851,
"formula_full": "Zr1 Sc1 Mn1 Ni3",
"formula_reduced": "ZrScMnNi3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.567460698563218,
"spacegroup": 160
},
{
"id": "jvasp-29032",
"created_at": "2022-09-04T14:36:54.888859Z",
"updated_at": "2022-09-04T14:36:54.888877Z",
"structure_string": "Te2 Mo2 W2 S6\n1.0\n3.288161 0.000000 0.000000\n-1.644081 2.846995 0.000023\n0.000000 0.000269 38.677376\nTe Mo W S\n2 2 2 6\ndirect\n0.666734 0.333467 0.419336 Te\n0.666732 0.333463 0.519251 Te\n0.333341 0.666682 0.469252 Mo\n0.666660 0.333320 0.281030 Mo\n0.333309 0.666619 0.093906 W\n0.666699 0.333398 0.658794 W\n0.333247 0.666495 0.320655 S\n0.333305 0.666611 0.698528 S\n0.666706 0.333413 0.054069 S\n0.666706 0.333412 0.133784 S\n0.333247 0.666494 0.241296 S\n0.333309 0.666618 0.618848 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.618984168408153,
"density_atomic": 0.03314243896934294,
"volume": 362.0735339092005,
"volume_molar": 18.170481555598652,
"formula_full": "Te2 Mo2 W2 S6",
"formula_reduced": "TeMoWS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.6921972777777774,
"spacegroup": 156
},
{
"id": "jvasp-99918",
"created_at": "2022-09-04T14:36:42.402306Z",
"updated_at": "2022-09-04T14:36:42.402325Z",
"structure_string": "Tl1 Bi1 Pb1 S3\n1.0\n5.462767 -0.010751 -5.196325\n-0.502743 3.945104 -6.405243\n0.017835 0.010751 7.539450\nTl Bi Pb S\n1 1 1 3\ndirect\n0.007114 0.007114 -0.000000 Tl\n0.337047 0.337047 -0.000000 Bi\n0.668077 0.668075 -0.000000 Pb\n0.482074 0.982072 0.500000 S\n0.188313 0.688311 0.500000 S\n0.817379 0.317378 0.500000 S\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Tl",
"Bi",
"Pb",
"S"
],
"chemical_system": "Bi-Pb-S-Tl",
"density": 7.292282749942522,
"density_atomic": 0.03676145391500645,
"volume": 163.21443689012338,
"volume_molar": 16.38167188360766,
"formula_full": "Tl1 Bi1 Pb1 S3",
"formula_reduced": "TlBiPbS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.06050462,
"spacegroup": 44
},
{
"id": "jvasp-104695",
"created_at": "2022-09-04T14:36:55.535697Z",
"updated_at": "2022-09-04T14:36:55.535728Z",
"structure_string": "Sm1 Mn1 Co3 Cu1\n1.0\n5.002144 0.000000 0.000000\n-2.501071 4.331984 0.000000\n0.000000 -0.000000 3.880781\nSm Mn Co Cu\n1 1 3 1\ndirect\n0.666666 0.333333 -0.000000 Sm\n0.333333 0.666666 -0.000000 Mn\n0.666034 0.833017 0.500000 Co\n0.166982 0.833017 0.500000 Co\n0.166983 0.333965 0.500000 Co\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Sm",
"Mn",
"Co",
"Cu"
],
"chemical_system": "Co-Cu-Mn-Sm",
"density": 8.799837074589542,
"density_atomic": 0.07134919560711557,
"volume": 84.09344981321173,
"volume_molar": 8.440376529485945,
"formula_full": "Sm1 Mn1 Co3 Cu1",
"formula_reduced": "SmMnCo3Cu",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.802111544396552,
"spacegroup": 187
}
]
}