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_molar&page=1064",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=1062",
"results": [
{
"id": "jvasp-112523",
"created_at": "2022-09-04T14:38:42.039671Z",
"updated_at": "2022-09-04T14:38:42.039689Z",
"structure_string": "Pu4 B8 Os4\n1.0\n5.355933 0.000000 0.000000\n0.000000 5.791352 0.000000\n-0.000000 0.000000 6.468314\nPu B Os\n4 8 4\ndirect\n0.750000 0.498743 0.163245 Pu\n0.750000 0.998743 0.336754 Pu\n0.250000 0.501257 0.836754 Pu\n0.250000 0.001257 0.663245 Pu\n0.914692 0.132557 0.964256 B\n0.585307 0.632556 0.535743 B\n0.414693 0.867443 0.035743 B\n0.085307 0.367443 0.464256 B\n0.085307 0.867443 0.035743 B\n0.414693 0.367443 0.464256 B\n0.585307 0.132557 0.964256 B\n0.914692 0.632556 0.535743 B\n0.750000 0.311084 0.686748 Os\n0.750000 0.811083 0.813251 Os\n0.250000 0.688916 0.313251 Os\n0.250000 0.188916 0.186749 Os\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Pu",
"B",
"Os"
],
"chemical_system": "B-Os-Pu",
"density": 15.091303776828251,
"density_atomic": 0.07974689647287823,
"volume": 200.6347670901722,
"volume_molar": 7.551567554792704,
"formula_full": "Pu4 B8 Os4",
"formula_reduced": "PuB2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.588435041666667,
"spacegroup": 62
},
{
"id": "jvasp-100343",
"created_at": "2022-09-04T14:36:38.470859Z",
"updated_at": "2022-09-04T14:36:38.470869Z",
"structure_string": "Sr1 Nd1 Al1 O4\n1.0\n3.612935 0.005783 -5.719809\n-0.297677 3.600655 -5.719809\n-0.005316 -0.005783 6.765314\nSr Nd Al O\n1 1 1 4\ndirect\n0.643772 0.643774 -0.000001 Sr\n0.359447 0.359448 -0.000001 Nd\n0.004276 0.004276 -0.000000 Al\n0.838927 0.838929 -0.000001 O\n0.165409 0.165409 -0.000000 O\n0.994080 0.494082 0.499998 O\n0.494080 0.994083 0.499999 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sr",
"Nd",
"Al",
"O"
],
"chemical_system": "Al-Nd-O-Sr",
"density": 6.107029714958324,
"density_atomic": 0.07974254743005617,
"volume": 87.78249787091194,
"volume_molar": 7.551979406329029,
"formula_full": "Sr1 Nd1 Al1 O4",
"formula_reduced": "SrNdAlO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5326949442857143,
"spacegroup": 107
},
{
"id": "jvasp-36200",
"created_at": "2022-09-04T14:37:28.803305Z",
"updated_at": "2022-09-04T14:37:28.803331Z",
"structure_string": "Al1 Cu3\n1.0\n3.687996 -0.000000 -0.000000\n-0.000000 3.687996 0.000000\n-0.000000 0.000000 3.687996\nAl Cu\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.000000 Cu\n0.500001 0.000000 0.500001 Cu\n0.000000 0.500001 0.500001 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Cu"
],
"chemical_system": "Al-Cu",
"density": 7.2040324200903,
"density_atomic": 0.0797422833767183,
"volume": 50.161593456049026,
"volume_molar": 7.552004413455553,
"formula_full": "Al1 Cu3",
"formula_reduced": "AlCu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0621510375,
"spacegroup": 221
},
{
"id": "jvasp-69808",
"created_at": "2022-09-04T14:36:03.255066Z",
"updated_at": "2022-09-04T14:36:03.255083Z",
"structure_string": "Ti1 Be1 Cu1\n1.0\n1.298787 -2.249565 -0.000000\n1.298787 2.249565 0.000000\n-0.000000 0.000000 6.439022\nTi Be Cu\n1 1 1\ndirect\n0.333334 0.666668 0.674655 Ti\n0.000000 0.000000 0.018489 Be\n0.666668 0.333334 0.306856 Cu\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Ti",
"density": 5.314715541714436,
"density_atomic": 0.079732406223703,
"volume": 37.6258555596953,
"volume_molar": 7.552939946530456,
"formula_full": "Ti1 Be1 Cu1",
"formula_reduced": "TiBeCu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6020049611111111,
"spacegroup": 156
},
{
"id": "jvasp-95704",
"created_at": "2022-09-04T14:36:02.321035Z",
"updated_at": "2022-09-04T14:36:02.321073Z",
"structure_string": "Bi12 Pt12 O44\n1.0\n9.483384 0.000000 -0.000000\n0.000000 9.483384 0.000000\n-0.000000 -0.000000 9.483384\nBi Pt O\n12 12 44\ndirect\n0.116679 0.383320 0.116679 Bi\n0.616679 0.616679 0.616679 Bi\n0.000000 0.500000 0.500000 Bi\n0.500000 0.500000 0.000000 Bi\n0.883320 0.883320 0.616679 Bi\n0.500000 0.000000 0.500000 Bi\n0.000000 0.000000 0.000000 Bi\n0.116679 0.116679 0.383320 Bi\n0.883320 0.616679 0.883320 Bi\n0.616679 0.883320 0.883320 Bi\n0.383320 0.383320 0.383320 Bi\n0.383320 0.116679 0.116679 Bi\n0.092012 0.250000 0.750000 Pt\n0.750000 0.092012 0.250000 Pt\n0.592012 0.750000 0.250000 Pt\n0.250000 0.592012 0.750000 Pt\n0.250000 0.750000 0.407987 Pt\n0.250000 0.907987 0.750000 Pt\n0.407987 0.250000 0.750000 Pt\n0.750000 0.250000 0.592012 Pt\n0.750000 0.250000 0.907987 Pt\n0.250000 0.750000 0.092012 Pt\n0.750000 0.407987 0.250000 Pt\n0.907987 0.750000 0.250000 Pt\n0.538614 0.254652 0.918478 O\n0.038615 0.745348 0.418478 O\n0.581522 0.538614 0.245348 O\n0.754652 0.081522 0.038615 O\n0.038615 0.754652 0.081522 O\n0.605218 0.250000 0.250000 O\n0.750000 0.394782 0.750000 O\n0.353114 0.146885 0.353114 O\n0.250000 0.894781 0.250000 O\n0.353114 0.353114 0.146885 O\n0.461385 0.745348 0.081522 O\n0.918478 0.538614 0.254652 O\n0.750000 0.750000 0.105218 O\n0.250000 0.250000 0.605218 O\n0.245348 0.918478 0.961385 O\n0.394782 0.750000 0.750000 O\n0.894781 0.250000 0.250000 O\n0.254652 0.581522 0.961385 O\n0.245348 0.581522 0.538614 O\n0.745348 0.081522 0.461385 O\n0.254652 0.918478 0.538614 O\n0.646885 0.646885 0.853114 O\n0.461385 0.754652 0.418478 O\n0.146885 0.353114 0.353114 O\n0.750000 0.105218 0.750000 O\n0.081522 0.461385 0.745348 O\n0.853114 0.853114 0.853114 O\n0.581522 0.961385 0.254652 O\n0.250000 0.250000 0.894781 O\n0.146885 0.146885 0.146885 O\n0.081522 0.038615 0.754652 O\n0.961385 0.254652 0.581522 O\n0.750000 0.750000 0.394782 O\n0.418478 0.038615 0.745348 O\n0.418478 0.461385 0.754652 O\n0.853114 0.646885 0.646885 O\n0.754652 0.418478 0.461385 O\n0.918478 0.961385 0.245348 O\n0.538614 0.245348 0.581522 O\n0.745348 0.418478 0.038615 O\n0.646885 0.853114 0.646885 O\n0.105218 0.750000 0.750000 O\n0.961385 0.245348 0.918478 O\n0.250000 0.605218 0.250000 O\n",
"nsites": 68,
"nelements": 3,
"elements": [
"Bi",
"Pt",
"O"
],
"chemical_system": "Bi-O-Pt",
"density": 10.811026396805858,
"density_atomic": 0.07972947488834516,
"volume": 852.8840820189602,
"volume_molar": 7.553217638061122,
"formula_full": "Bi12 Pt12 O44",
"formula_reduced": "Bi3Pt3O11",
"formula_anonymous": "A3B3C11",
"energy_above_hull": 2.671076211764705,
"spacegroup": 201
},
{
"id": "jvasp-42505",
"created_at": "2022-09-04T14:38:29.684866Z",
"updated_at": "2022-09-04T14:38:29.684893Z",
"structure_string": "Cd4 Sn4 O12\n1.0\n5.543044 -0.000000 0.000000\n0.000000 5.652266 0.000000\n0.000000 0.000000 8.006471\nCd Sn O\n4 4 12\ndirect\n0.010403 0.955243 0.750000 Cd\n0.489596 0.455242 0.750000 Cd\n0.510403 0.544759 0.250000 Cd\n0.989596 0.044758 0.250000 Cd\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.807148 0.803587 0.060924 O\n0.692851 0.303587 0.439076 O\n0.692851 0.303587 0.060924 O\n0.613303 0.053411 0.750000 O\n0.386697 0.946590 0.250000 O\n0.192851 0.196414 0.560924 O\n0.307148 0.696414 0.560924 O\n0.192851 0.196414 0.939076 O\n0.807148 0.803587 0.439076 O\n0.113303 0.446590 0.250000 O\n0.307148 0.696414 0.939076 O\n0.886696 0.553411 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Cd",
"Sn",
"O"
],
"chemical_system": "Cd-O-Sn",
"density": 7.390719973948077,
"density_atomic": 0.07972929847935908,
"volume": 250.84881444401208,
"volume_molar": 7.553234350304809,
"formula_full": "Cd4 Sn4 O12",
"formula_reduced": "CdSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.91363439,
"spacegroup": 62
},
{
"id": "jvasp-52291",
"created_at": "2022-09-04T14:36:32.289990Z",
"updated_at": "2022-09-04T14:36:32.290000Z",
"structure_string": "Sr4 Li1 Cu1 C2 O10\n1.0\n0.000000 5.543269 -0.000000\n2.771634 -2.771634 7.347557\n5.543269 0.000000 0.000000\nSr Li Cu C O\n4 1 1 2 10\ndirect\n0.114130 0.228260 0.385870 Sr\n0.385871 0.771740 0.114129 Sr\n0.614130 0.228260 0.885870 Sr\n0.885871 0.771740 0.614129 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Cu\n0.763147 0.526291 0.236854 C\n0.236855 0.473709 0.763146 C\n0.424175 0.559605 0.575826 O\n0.732619 0.993215 0.739401 O\n0.267383 0.006785 0.732618 O\n0.864569 0.440395 0.424174 O\n0.739402 0.006785 0.260598 O\n0.575827 0.440395 0.135431 O\n0.260599 0.993215 0.267382 O\n0.148363 0.296726 0.851637 O\n0.851638 0.703274 0.148362 O\n0.135432 0.559605 0.864568 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Sr",
"Li",
"Cu",
"C",
"O"
],
"chemical_system": "C-Cu-Li-O-Sr",
"density": 4.449558956513303,
"density_atomic": 0.07972556996293352,
"volume": 225.7744912751162,
"volume_molar": 7.55358759153412,
"formula_full": "Sr4 Li1 Cu1 C2 O10",
"formula_reduced": "Sr4LiCu(CO5)2",
"formula_anonymous": "ABC2D4E10",
"energy_above_hull": 2.2573061494444446,
"spacegroup": 121
},
{
"id": "jvasp-69399",
"created_at": "2022-09-04T14:35:59.293088Z",
"updated_at": "2022-09-04T14:35:59.293115Z",
"structure_string": "Hf1 Mn1 Be2\n1.0\n-1.808561 1.808561 3.834744\n1.808561 -1.808561 3.834744\n1.808561 1.808561 -3.834744\nHf Mn Be\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Hf\n0.749999 0.250000 0.500000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mn",
"Be"
],
"chemical_system": "Be-Hf-Mn",
"density": 8.322277776221554,
"density_atomic": 0.07972550898018348,
"volume": 50.172147549340046,
"volume_molar": 7.55359336934037,
"formula_full": "Hf1 Mn1 Be2",
"formula_reduced": "HfMnBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.3910681103448272,
"spacegroup": 119
},
{
"id": "jvasp-9193",
"created_at": "2022-09-04T14:37:11.226112Z",
"updated_at": "2022-09-04T14:37:11.226138Z",
"structure_string": "Ba2 Al1 V3 O8\n1.0\n0.000000 3.796388 0.318930\n4.083258 0.000000 0.000000\n0.000000 -0.950584 -11.408165\nBa Al V O\n2 1 3 8\ndirect\n0.439259 0.500000 0.842592 Ba\n0.614201 0.500000 0.192712 Ba\n0.286163 0.500000 0.536633 Al\n-0.166109 0.000000 0.632166 V\n0.026005 0.000000 0.016200 V\n0.197662 0.000000 0.359727 V\n-0.185376 0.500000 0.593719 O\n0.301377 0.000000 0.567086 O\n0.520667 0.000000 0.005513 O\n0.918459 0.000000 0.800961 O\n0.208993 0.500000 0.382381 O\n0.704820 0.000000 0.374044 O\n0.112030 0.000000 0.188359 O\n0.021855 0.500000 0.007905 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Al",
"V",
"O"
],
"chemical_system": "Al-Ba-O-V",
"density": 5.507686440438296,
"density_atomic": 0.0797233592343124,
"volume": 175.60725155663656,
"volume_molar": 7.553797052505676,
"formula_full": "Ba2 Al1 V3 O8",
"formula_reduced": "Ba2AlV3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.77321681,
"spacegroup": 38
},
{
"id": "jvasp-85599",
"created_at": "2022-09-04T14:36:08.985135Z",
"updated_at": "2022-09-04T14:36:08.985154Z",
"structure_string": "La3 C3 O9 F3\n1.0\n7.262620 -0.000000 0.000000\n-3.631310 6.289614 -0.000000\n-0.000000 -0.000000 4.943116\nLa C O F\n3 3 9 3\ndirect\n0.673652 0.673652 0.000000 La\n0.326348 0.000000 0.000000 La\n-0.000000 0.326348 0.000000 La\n0.602683 0.000000 0.500000 C\n-0.000000 0.602683 0.500000 C\n0.397317 0.397317 0.500000 C\n-0.000000 0.423033 0.500000 O\n0.576966 0.576966 0.500000 O\n0.313003 0.313003 0.270712 O\n0.686996 0.000000 0.729288 O\n0.686996 0.000000 0.270712 O\n0.423033 0.000000 0.500000 O\n0.313003 0.313003 0.729288 O\n-0.000000 0.686996 0.270712 O\n-0.000000 0.686996 0.729288 O\n0.666667 0.333333 0.000000 F\n0.000000 0.000000 0.000000 F\n0.333333 0.666667 0.000000 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"La",
"C",
"O",
"F"
],
"chemical_system": "C-F-La-O",
"density": 4.807673025527016,
"density_atomic": 0.0797176318008993,
"volume": 225.79697355983097,
"volume_molar": 7.554339766440557,
"formula_full": "La3 C3 O9 F3",
"formula_reduced": "LaCO3F",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.295069297083333,
"spacegroup": 189
},
{
"id": "jvasp-92488",
"created_at": "2022-09-04T14:35:59.184535Z",
"updated_at": "2022-09-04T14:35:59.184554Z",
"structure_string": "La1 Re1 N3\n1.0\n3.973195 -0.000000 0.000000\n-0.000000 3.973195 0.000000\n0.000000 -0.000000 3.973195\nLa Re N\n1 1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500001 0.500001 0.500001 Re\n0.000000 0.500001 0.500001 N\n0.500001 0.000000 0.500001 N\n0.500001 0.500001 0.000000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Re",
"N"
],
"chemical_system": "La-N-Re",
"density": 9.719689045662655,
"density_atomic": 0.07971689299677012,
"volume": 62.72196283669239,
"volume_molar": 7.554409778921009,
"formula_full": "La1 Re1 N3",
"formula_reduced": "LaReN3",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.989548549999999,
"spacegroup": 221
},
{
"id": "jvasp-118288",
"created_at": "2022-09-04T14:38:50.810558Z",
"updated_at": "2022-09-04T14:38:50.810591Z",
"structure_string": "Zr1 Mn1 F3\n1.0\n3.973195 -0.000000 0.000000\n-0.000000 3.973195 -0.000000\n0.000000 0.000000 3.973195\nZr Mn F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 F\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Mn",
"F"
],
"chemical_system": "F-Mn-Zr",
"density": 5.37850766572554,
"density_atomic": 0.07971689299677012,
"volume": 62.72196283669239,
"volume_molar": 7.554409778921009,
"formula_full": "Zr1 Mn1 F3",
"formula_reduced": "ZrMnF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4934085177758618,
"spacegroup": 221
}
]
}