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=-energy_above_hull&page=876",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=874",
"results": [
{
"id": "jvasp-28417",
"created_at": "2022-09-04T14:36:43.585184Z",
"updated_at": "2022-09-04T14:36:43.585198Z",
"structure_string": "Te2 W2 Se2\n1.0\n3.442803 -0.000000 -0.000000\n-1.721401 2.981556 -0.000138\n-0.000000 -0.001076 23.031610\nTe W Se\n2 2 2\ndirect\n0.333418 0.666837 0.531347 Te\n0.333360 0.666722 0.369184 Te\n0.333276 0.666554 0.151541 W\n0.666722 0.333447 0.450328 W\n0.666585 0.333169 0.080328 Se\n0.666635 0.333272 0.222875 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Te",
"W",
"Se"
],
"chemical_system": "Se-Te-W",
"density": 5.484151727115786,
"density_atomic": 0.025378842465139523,
"volume": 236.41740194579887,
"volume_molar": 23.728981210518313,
"formula_full": "Te2 W2 Se2",
"formula_reduced": "TeWSe",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0032203777777777,
"spacegroup": 156
},
{
"id": "jvasp-75893",
"created_at": "2022-09-04T14:35:58.012262Z",
"updated_at": "2022-09-04T14:35:58.012287Z",
"structure_string": "Ca1 B2 As1\n1.0\n0.000000 3.177331 3.177331\n3.177331 0.000000 3.177331\n3.177331 3.177331 0.000000\nCa B As\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Ca\n0.000000 0.000000 0.000000 B\n0.250000 0.250000 0.250000 B\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"B",
"As"
],
"chemical_system": "As-B-Ca",
"density": 3.536316186228702,
"density_atomic": 0.062350884055508426,
"volume": 64.15305990591833,
"volume_molar": 9.658468923453814,
"formula_full": "Ca1 B2 As1",
"formula_reduced": "CaB2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.003181834166667,
"spacegroup": 216
},
{
"id": "jvasp-37620",
"created_at": "2022-09-04T14:38:04.025230Z",
"updated_at": "2022-09-04T14:38:04.025257Z",
"structure_string": "Sm1 Pu1 O3\n1.0\n4.333835 0.000000 0.000000\n-0.000000 4.333835 -0.000000\n0.000000 -0.000000 4.333835\nSm Pu O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500001 0.500001 0.500001 Pu\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n0.500001 0.500001 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Pu",
"O"
],
"chemical_system": "O-Pu-Sm",
"density": 9.024144935236713,
"density_atomic": 0.06142609208715574,
"volume": 81.39863419775494,
"volume_molar": 9.803880656212598,
"formula_full": "Sm1 Pu1 O3",
"formula_reduced": "SmPuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.0031558750000005,
"spacegroup": 221
},
{
"id": "jvasp-118818",
"created_at": "2022-09-04T14:38:50.255428Z",
"updated_at": "2022-09-04T14:38:50.255457Z",
"structure_string": "Y1 Nb1 O1\n1.0\n3.026998 -0.000000 -0.000000\n-0.000000 3.026998 0.000000\n-0.000000 0.000000 7.147150\nY Nb O\n1 1 1\ndirect\n0.000000 0.000000 0.712895 Y\n0.000000 0.000000 0.262895 Nb\n0.000000 0.000000 0.005048 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Nb",
"O"
],
"chemical_system": "Nb-O-Y",
"density": 5.015840919976119,
"density_atomic": 0.04581040062250536,
"volume": 65.48731203468638,
"volume_molar": 13.14579370223078,
"formula_full": "Y1 Nb1 O1",
"formula_reduced": "YNbO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.00287945,
"spacegroup": 99
},
{
"id": "jvasp-35199",
"created_at": "2022-09-04T14:38:13.200983Z",
"updated_at": "2022-09-04T14:38:13.200995Z",
"structure_string": "Sr3 Ge2 B6 O16\n1.0\n-5.037072 0.012261 -0.002423\n-0.043006 -7.355251 -0.035900\n1.893656 1.958266 8.097154\nSr Ge B O\n3 2 6 16\ndirect\n0.096795 0.094724 0.741665 Sr\n0.903205 0.905275 0.258335 Sr\n-0.000000 0.500000 0.500000 Sr\n0.700652 0.313062 0.052289 Ge\n0.299348 0.686938 0.947711 Ge\n0.730371 0.760076 0.804771 B\n0.269629 0.239923 0.195229 B\n0.539636 0.409915 0.739546 B\n0.540967 0.186796 0.459396 B\n0.459033 0.813204 0.540603 B\n0.460363 0.590085 0.260453 B\n0.264025 0.682431 0.147852 O\n0.029728 0.810468 0.858135 O\n0.970272 0.189531 0.141865 O\n0.669542 0.566654 0.704390 O\n0.330458 0.433346 0.295610 O\n0.735975 0.317568 0.852148 O\n0.293064 0.462851 0.809325 O\n0.186075 0.822180 0.512658 O\n0.410549 0.271413 0.583975 O\n0.589451 0.728586 0.416025 O\n0.813925 0.177820 0.487342 O\n0.382467 0.202712 0.044178 O\n0.376770 0.108814 0.301190 O\n0.623229 0.891186 0.698810 O\n0.706936 0.537148 0.190675 O\n0.617533 0.797287 0.955822 O\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Sr",
"Ge",
"B",
"O"
],
"chemical_system": "B-Ge-O-Sr",
"density": 4.040387500130452,
"density_atomic": 0.09011815709882015,
"volume": 299.60665940375173,
"volume_molar": 6.682494353936188,
"formula_full": "Sr3 Ge2 B6 O16",
"formula_reduced": "Sr3Ge2(B3O8)2",
"formula_anonymous": "A2B3C6D16",
"energy_above_hull": 3.0028008270370368,
"spacegroup": 2
},
{
"id": "jvasp-9405",
"created_at": "2022-09-04T14:37:07.749805Z",
"updated_at": "2022-09-04T14:37:07.749834Z",
"structure_string": "Tl1 Cr5 Se8\n1.0\n3.599155 -0.000000 -0.698789\n-0.430523 8.695999 -2.217439\n-0.004371 -0.003546 9.595726\nTl Cr Se\n1 5 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500001 0.500000 -0.000000 Cr\n0.157377 0.474828 0.314753 Cr\n0.203953 0.835588 0.407904 Cr\n0.796049 0.164412 0.592097 Cr\n0.842626 0.525172 0.685248 Cr\n0.925332 0.343175 0.850661 Se\n0.330831 0.007177 0.661661 Se\n0.669171 0.992822 0.338339 Se\n0.415045 0.678808 0.830087 Se\n0.584957 0.321191 0.169913 Se\n0.737864 0.656556 0.475725 Se\n0.262138 0.343444 0.524275 Se\n0.074671 0.656825 0.149340 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Tl",
"Cr",
"Se"
],
"chemical_system": "Cr-Se-Tl",
"density": 6.06121962137283,
"density_atomic": 0.04662416305782061,
"volume": 300.27348657471885,
"volume_molar": 12.916351447492337,
"formula_full": "Tl1 Cr5 Se8",
"formula_reduced": "TlCr5Se8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 3.0026376095238105,
"spacegroup": 12
},
{
"id": "jvasp-79013",
"created_at": "2022-09-04T14:36:36.823384Z",
"updated_at": "2022-09-04T14:36:36.823403Z",
"structure_string": "La1 Ho1 Ru2\n1.0\n0.000000 3.466155 3.466155\n3.466155 0.000000 3.466155\n3.466155 3.466155 -0.000000\nLa Ho Ru\n1 1 2\ndirect\n0.750001 0.750001 0.750001 La\n0.250001 0.250001 0.250001 Ho\n0.000000 0.000000 0.000000 Ru\n0.500001 0.500001 0.500001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Ho",
"Ru"
],
"chemical_system": "Ho-La-Ru",
"density": 10.087995968254274,
"density_atomic": 0.04802706606032205,
"volume": 83.28637012671136,
"volume_molar": 12.53905610731287,
"formula_full": "La1 Ho1 Ru2",
"formula_reduced": "LaHoRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0026203916666665,
"spacegroup": 225
},
{
"id": "jvasp-18281",
"created_at": "2022-09-04T14:38:07.671439Z",
"updated_at": "2022-09-04T14:38:07.671465Z",
"structure_string": "Lu2 Co2 C2\n1.0\n3.588946 -0.000000 0.000000\n0.000000 3.588946 0.000000\n0.000000 0.000000 6.592758\nLu Co C\n2 2 2\ndirect\n0.000000 0.000000 0.750000 Lu\n0.000000 0.000000 0.250000 Lu\n0.500001 0.500001 0.000000 Co\n0.500001 0.500001 0.500000 Co\n0.500001 0.000000 0.500000 C\n0.000000 0.500001 0.000000 C\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Lu",
"Co",
"C"
],
"chemical_system": "C-Co-Lu",
"density": 9.617360185025422,
"density_atomic": 0.07065619861274262,
"volume": 84.91823955722859,
"volume_molar": 8.52315986175051,
"formula_full": "Lu2 Co2 C2",
"formula_reduced": "LuCoC",
"formula_anonymous": "ABC",
"energy_above_hull": 3.00256555,
"spacegroup": 131
},
{
"id": "jvasp-40565",
"created_at": "2022-09-04T14:37:47.120159Z",
"updated_at": "2022-09-04T14:37:47.120179Z",
"structure_string": "Sc1 Mn1 Rh2\n1.0\n0.000016 3.126419 3.126419\n3.126419 0.000016 3.126419\n3.126419 3.126419 0.000016\nSc Mn Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sc\n0.250001 0.250001 0.250001 Mn\n0.999992 0.999992 0.999992 Rh\n0.500010 0.500010 0.500010 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Mn",
"Rh"
],
"chemical_system": "Mn-Rh-Sc",
"density": 8.305836398132872,
"density_atomic": 0.06544730766190753,
"volume": 61.117869365436576,
"volume_molar": 9.201510306748773,
"formula_full": "Sc1 Mn1 Rh2",
"formula_reduced": "ScMnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0025196228448268,
"spacegroup": 225
},
{
"id": "jvasp-24296",
"created_at": "2022-09-04T14:38:28.695299Z",
"updated_at": "2022-09-04T14:38:28.695317Z",
"structure_string": "Na2 Nb6 Te8 O32\n1.0\n0.000000 6.646138 0.015698\n7.521395 0.000000 0.000000\n0.000000 -3.024459 -13.936279\nNa Nb Te O\n2 6 8 32\ndirect\n0.500000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.078408 0.498978 0.275601 Nb\n0.078408 0.001023 0.275601 Nb\n0.921592 0.501023 0.724399 Nb\n0.000000 0.500000 0.000000 Nb\n0.921592 0.998978 0.724399 Nb\n0.000000 0.000000 0.000000 Nb\n0.418824 0.250000 0.711964 Te\n0.947151 0.250000 0.497776 Te\n0.505358 0.750000 0.003446 Te\n0.413615 0.750000 0.723499 Te\n0.052849 0.750000 0.502224 Te\n0.586385 0.250000 0.276501 Te\n0.494642 0.250000 -0.003446 Te\n0.581176 0.750000 0.288036 Te\n0.051273 0.458639 0.142926 O\n0.298649 0.440149 0.002975 O\n0.124005 0.941847 0.427748 O\n0.701351 0.940149 0.997025 O\n0.619369 0.250000 0.125050 O\n0.085385 0.750000 0.023528 O\n0.643582 0.250000 0.421944 O\n0.298649 0.059851 0.002975 O\n0.124005 0.558154 0.427748 O\n0.701351 0.559852 0.997025 O\n0.914615 0.250000 0.976472 O\n0.616944 0.061696 0.703505 O\n0.383056 0.938304 0.296495 O\n0.875995 0.441847 0.572252 O\n0.987537 0.750000 0.259599 O\n0.779522 0.054782 0.283101 O\n0.616944 0.438304 0.703505 O\n0.051273 0.041361 0.142926 O\n0.875995 0.058154 0.572252 O\n0.220478 0.945219 0.716899 O\n0.948727 0.541362 0.857074 O\n0.356418 0.750000 0.578056 O\n0.948727 0.958639 0.857074 O\n0.696577 0.750000 0.419746 O\n0.380632 0.750000 0.874950 O\n0.149894 0.250000 0.316152 O\n0.303423 0.250000 0.580254 O\n0.779522 0.445219 0.283101 O\n0.383056 0.561697 0.296495 O\n0.012463 0.250000 0.740401 O\n0.850106 0.750000 0.683848 O\n0.220478 0.554782 0.716899 O\n",
"nsites": 48,
"nelements": 4,
"elements": [
"Na",
"Nb",
"Te",
"O"
],
"chemical_system": "Na-Nb-O-Te",
"density": 5.094467762652135,
"density_atomic": 0.06893651563974501,
"volume": 696.2928072959614,
"volume_molar": 8.735777699399657,
"formula_full": "Na2 Nb6 Te8 O32",
"formula_reduced": "NaNb3(TeO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 3.0024601777777784,
"spacegroup": 11
},
{
"id": "jvasp-109514",
"created_at": "2022-09-04T14:38:17.885906Z",
"updated_at": "2022-09-04T14:38:17.885939Z",
"structure_string": "Co1 Rh3\n1.0\n3.752152 0.000000 0.000000\n0.000000 3.752152 0.000000\n0.000000 0.000000 3.752152\nCo Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 -0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Rh"
],
"chemical_system": "Co-Rh",
"density": 11.556918147509451,
"density_atomic": 0.07572141503901068,
"volume": 52.825214609886146,
"volume_molar": 7.953021951448572,
"formula_full": "Co1 Rh3",
"formula_reduced": "CoRh3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.0021174750000004,
"spacegroup": 221
},
{
"id": "jvasp-37042",
"created_at": "2022-09-04T14:35:47.393836Z",
"updated_at": "2022-09-04T14:35:47.393859Z",
"structure_string": "Ti3 Ge1\n1.0\n3.168015 3.168015 0.000000\n3.168015 0.000000 -3.168015\n-0.000000 3.168015 -3.168015\nTi Ge\n3 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.499999 0.499999 Ti\n0.749999 0.749999 0.749999 Ti\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ge"
],
"chemical_system": "Ge-Ti",
"density": 5.646709624030485,
"density_atomic": 0.06290255816151377,
"volume": 63.590418528436814,
"volume_molar": 9.573761284138964,
"formula_full": "Ti3 Ge1",
"formula_reduced": "Ti3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 3.0019302375000008,
"spacegroup": 225
}
]
}