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=nelements&page=3508",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3506",
"results": [
{
"id": "jvasp-92568",
"created_at": "2022-09-04T14:35:41.696597Z",
"updated_at": "2022-09-04T14:35:41.696625Z",
"structure_string": "K1 Fe2 Te2\n1.0\n3.875471 -0.000000 -0.000000\n-0.000000 3.875471 -0.000000\n-1.937735 -1.937735 8.125409\nK Fe Te\n1 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.250001 0.750000 0.500000 Fe\n0.750000 0.250001 0.500000 Fe\n0.638956 0.638956 0.277912 Te\n0.361045 0.361045 0.722088 Te\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Fe",
"Te"
],
"chemical_system": "Fe-K-Te",
"density": 5.524187385272946,
"density_atomic": 0.04097092703192007,
"volume": 122.0377560923761,
"volume_molar": 14.698570904456728,
"formula_full": "K1 Fe2 Te2",
"formula_reduced": "K(FeTe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.5962849066666664,
"spacegroup": 139
},
{
"id": "jvasp-97601",
"created_at": "2022-09-04T14:35:41.735100Z",
"updated_at": "2022-09-04T14:35:41.735124Z",
"structure_string": "Th6 Fe24 P12\n1.0\n3.711848 0.000000 0.000000\n0.000000 10.707980 -0.000000\n0.000000 -0.000000 14.277972\nTh Fe P\n6 24 12\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.375956 0.225808 Th\n0.500000 0.624044 0.774192 Th\n0.500000 0.500000 0.500000 Th\n0.000000 0.124044 0.725808 Th\n0.000000 0.875957 0.274192 Th\n0.000000 0.432875 0.674982 Fe\n0.000000 0.567125 0.325018 Fe\n0.500000 0.932875 0.825018 Fe\n0.500000 0.067125 0.174982 Fe\n0.000000 0.822350 0.710192 Fe\n0.000000 0.177651 0.289808 Fe\n0.500000 0.322350 0.789808 Fe\n0.500000 0.240378 0.037384 Fe\n0.500000 0.766052 0.578139 Fe\n0.000000 0.733948 0.078139 Fe\n0.000000 0.266052 0.921861 Fe\n0.500000 0.908799 0.448411 Fe\n0.000000 0.922151 0.553531 Fe\n0.500000 0.677651 0.210192 Fe\n0.500000 0.233948 0.421861 Fe\n0.500000 0.759622 0.962616 Fe\n0.000000 0.259622 0.537384 Fe\n0.500000 0.422151 0.946469 Fe\n0.500000 0.091201 0.551589 Fe\n0.000000 0.408799 0.051589 Fe\n0.000000 0.591201 0.948411 Fe\n0.500000 0.577849 0.053531 Fe\n0.000000 0.077849 0.446469 Fe\n0.000000 0.740378 0.462616 Fe\n0.500000 0.149989 0.886312 P\n0.000000 0.350011 0.386312 P\n0.000000 0.649989 0.613688 P\n0.500000 0.701107 0.367120 P\n0.500000 0.298893 0.632880 P\n0.000000 0.429268 0.834015 P\n0.500000 0.929268 0.665985 P\n0.000000 0.570732 0.165985 P\n0.000000 0.201107 0.132880 P\n0.000000 0.798893 0.867120 P\n0.500000 0.070732 0.334015 P\n0.500000 0.850011 0.113688 P\n",
"nsites": 42,
"nelements": 3,
"elements": [
"Th",
"Fe",
"P"
],
"chemical_system": "Fe-P-Th",
"density": 9.083090102816767,
"density_atomic": 0.07400908408256227,
"volume": 567.4979027324009,
"volume_molar": 8.137029169665016,
"formula_full": "Th6 Fe24 P12",
"formula_reduced": "Th(Fe2P)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.657309799999999,
"spacegroup": 58
},
{
"id": "jvasp-68618",
"created_at": "2022-09-04T14:35:41.737313Z",
"updated_at": "2022-09-04T14:35:41.737341Z",
"structure_string": "Sc2 Be1 In1\n1.0\n-2.064050 2.064050 4.630548\n2.064050 -2.064050 4.630548\n2.064050 2.064050 -4.630548\nSc Be In\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.250000 0.750000 0.500000 Sc\n0.500000 0.500000 0.000000 Be\n0.750000 0.250000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"In"
],
"chemical_system": "Be-In-Sc",
"density": 4.497862445653127,
"density_atomic": 0.050690570904816136,
"volume": 78.91013907716628,
"volume_molar": 11.880199122846797,
"formula_full": "Sc2 Be1 In1",
"formula_reduced": "Sc2BeIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6382816425,
"spacegroup": 119
},
{
"id": "jvasp-85661",
"created_at": "2022-09-04T14:35:41.739891Z",
"updated_at": "2022-09-04T14:35:41.739917Z",
"structure_string": "Ba4 H12 Pt2\n1.0\n7.259677 3.006177 -0.000000\n-7.259677 3.006177 -0.000000\n0.000000 0.000000 6.012338\nBa H Pt\n4 12 2\ndirect\n0.141539 0.858462 0.500000 Ba\n0.641539 0.358462 0.000000 Ba\n0.858462 0.141539 0.500000 Ba\n0.358462 0.641539 0.000000 Ba\n0.801950 0.801950 0.801986 H\n0.198051 0.198051 0.198014 H\n0.698051 0.698051 0.301986 H\n0.301949 0.301949 0.698014 H\n0.115238 0.884763 0.000000 H\n0.615238 0.384763 0.500000 H\n0.384763 0.615238 0.500000 H\n0.499769 -0.000231 0.750000 H\n0.000232 0.500232 0.250000 H\n0.500232 0.000232 0.250000 H\n-0.000231 0.499769 0.750000 H\n0.884763 0.115238 0.000000 H\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ba",
"H",
"Pt"
],
"chemical_system": "Ba-H-Pt",
"density": 6.021229682814189,
"density_atomic": 0.06859102229242418,
"volume": 262.42501421338466,
"volume_molar": 8.779779858544464,
"formula_full": "Ba4 H12 Pt2",
"formula_reduced": "Ba2H6Pt",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.2421137044444444,
"spacegroup": 64
},
{
"id": "jvasp-16049",
"created_at": "2022-09-04T14:35:41.777485Z",
"updated_at": "2022-09-04T14:35:41.777513Z",
"structure_string": "Th1 Si2 Tc2\n1.0\n3.993326 -0.000000 -1.533110\n-0.588589 3.949711 -1.533110\n-0.066704 -0.077381 5.793562\nTh Si Tc\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.630678 0.630677 0.261354 Si\n0.369324 0.369323 0.738646 Si\n0.750001 0.250000 0.500000 Tc\n0.250001 0.750000 0.500000 Tc\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Si",
"Tc"
],
"chemical_system": "Si-Tc-Th",
"density": 8.891250852692274,
"density_atomic": 0.05529054349570275,
"volume": 90.43137730032635,
"volume_molar": 10.891809664464681,
"formula_full": "Th1 Si2 Tc2",
"formula_reduced": "Th(SiTc)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.257391159999999,
"spacegroup": 139
},
{
"id": "jvasp-85738",
"created_at": "2022-09-04T14:35:41.787217Z",
"updated_at": "2022-09-04T14:35:41.787251Z",
"structure_string": "U4 In2 Rh4\n1.0\n3.557885 0.000034 -0.000013\n0.000098 7.656774 0.000078\n-0.000065 0.000054 7.656492\nU In Rh\n4 2 4\ndirect\n0.499993 0.835148 0.335155 U\n0.499992 0.664856 0.835148 U\n0.500009 0.335148 0.164853 U\n0.500003 0.164845 0.664847 U\n-0.000007 0.000003 0.000002 In\n0.000004 0.499995 0.500004 In\n-0.000007 0.638334 0.138331 Rh\n0.000009 0.361667 0.861667 Rh\n0.000001 0.861668 0.638329 Rh\n-0.000003 0.138333 0.361665 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"U",
"In",
"Rh"
],
"chemical_system": "In-Rh-U",
"density": 12.685253708751445,
"density_atomic": 0.047943797687536,
"volume": 208.57755293339457,
"volume_molar": 12.56083383141253,
"formula_full": "U4 In2 Rh4",
"formula_reduced": "U2InRh2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.585889594,
"spacegroup": 127
},
{
"id": "jvasp-90455",
"created_at": "2022-09-04T14:35:41.690681Z",
"updated_at": "2022-09-04T14:35:41.690700Z",
"structure_string": "Mg6 Zr1 C1\n1.0\n6.305052 0.828654 0.000000\n-2.434889 5.874662 0.000000\n0.000000 0.000000 4.555478\nMg Zr C\n6 1 1\ndirect\n0.217032 0.892835 0.250000 Mg\n0.607164 0.282968 0.250000 Mg\n0.702884 0.797115 0.250000 Mg\n0.427679 0.617738 0.750000 Mg\n0.882261 0.072320 0.750000 Mg\n0.908024 0.591974 0.750000 Mg\n0.135873 0.364127 0.250000 Zr\n0.119079 0.380921 0.750000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Zr",
"C"
],
"chemical_system": "C-Mg-Zr",
"density": 2.324450623795909,
"density_atomic": 0.04496235348005957,
"volume": 177.92662929772868,
"volume_molar": 13.393740082290776,
"formula_full": "Mg6 Zr1 C1",
"formula_reduced": "Mg6ZrC",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.7835736,
"spacegroup": 38
},
{
"id": "jvasp-87059",
"created_at": "2022-09-04T14:35:41.705545Z",
"updated_at": "2022-09-04T14:35:41.705560Z",
"structure_string": "Li3 La1 Sb2\n1.0\n4.620464 0.000000 -0.000000\n-2.310232 4.001439 0.000000\n0.000000 0.000000 7.441591\nLi La Sb\n3 1 2\ndirect\n0.000000 0.000000 0.500000 Li\n0.666667 0.333333 0.356479 Li\n0.333333 0.666667 0.643521 Li\n0.000000 0.000000 0.000000 La\n0.333333 0.666667 0.259271 Sb\n0.666667 0.333333 0.740729 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"La",
"Sb"
],
"chemical_system": "La-Li-Sb",
"density": 4.866920333197503,
"density_atomic": 0.043609756522101806,
"volume": 137.58389127807095,
"volume_molar": 13.809159326417992,
"formula_full": "Li3 La1 Sb2",
"formula_reduced": "Li3LaSb2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.1742712000000002,
"spacegroup": 164
},
{
"id": "jvasp-68511",
"created_at": "2022-09-04T14:35:41.708023Z",
"updated_at": "2022-09-04T14:35:41.708057Z",
"structure_string": "Be1 Nb1 Ru1\n1.0\n1.491804 -2.583880 0.000000\n1.491804 2.583880 -0.000000\n0.000000 0.000000 5.430382\nBe Nb Ru\n1 1 1\ndirect\n0.000000 0.000000 0.024220 Be\n0.333332 0.666666 0.682973 Nb\n0.666666 0.333332 0.292807 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Ru"
],
"chemical_system": "Be-Nb-Ru",
"density": 8.05148855645956,
"density_atomic": 0.07165999446503515,
"volume": 41.864362708872115,
"volume_molar": 8.403769502017425,
"formula_full": "Be1 Nb1 Ru1",
"formula_reduced": "BeNbRu",
"formula_anonymous": "ABC",
"energy_above_hull": 3.524405333333333,
"spacegroup": 156
},
{
"id": "jvasp-64377",
"created_at": "2022-09-04T14:35:41.716842Z",
"updated_at": "2022-09-04T14:35:41.716860Z",
"structure_string": "Ba4 Li1 Hf1\n1.0\n0.000000 5.129875 5.129875\n5.129875 -0.000000 5.129875\n5.129875 5.129875 0.000000\nBa Li Hf\n4 1 1\ndirect\n0.128069 0.623976 0.623976 Ba\n0.623976 0.623976 0.623976 Ba\n0.623976 0.128069 0.623976 Ba\n0.623976 0.623976 0.128069 Ba\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Hf\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Hf"
],
"chemical_system": "Ba-Hf-Li",
"density": 4.518890797175937,
"density_atomic": 0.022222908926081072,
"volume": 269.99165680593364,
"volume_molar": 27.098796021849072,
"formula_full": "Ba4 Li1 Hf1",
"formula_reduced": "Ba4LiHf",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1006594799999998,
"spacegroup": 216
},
{
"id": "jvasp-63285",
"created_at": "2022-09-04T14:35:41.718493Z",
"updated_at": "2022-09-04T14:35:41.718527Z",
"structure_string": "K4 Ag2 As2\n1.0\n3.938265 -4.965620 0.000000\n3.938265 4.965620 0.000000\n0.000000 0.000000 6.026267\nK Ag As\n4 2 2\ndirect\n0.683751 0.029093 0.249982 K\n0.316248 0.970906 0.749982 K\n0.029093 0.683751 0.250018 K\n0.970906 0.316248 0.750018 K\n0.500048 0.499951 0.000000 Ag\n0.499951 0.500048 0.500000 Ag\n0.236313 0.236313 0.250000 As\n0.763686 0.763686 0.750000 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Ag",
"As"
],
"chemical_system": "Ag-As-K",
"density": 3.677394204332225,
"density_atomic": 0.03394166981290975,
"volume": 235.69848048422153,
"volume_molar": 17.74261782992619,
"formula_full": "K4 Ag2 As2",
"formula_reduced": "K2AgAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 7.500000000021378e-06,
"spacegroup": 63
},
{
"id": "jvasp-65101",
"created_at": "2022-09-04T14:35:41.767765Z",
"updated_at": "2022-09-04T14:35:41.767797Z",
"structure_string": "Be1 Re1 Bi4\n1.0\n-0.000000 4.517301 4.517301\n4.517301 -0.000000 4.517301\n4.517301 4.517301 0.000000\nBe Re Bi\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Re\n0.123793 0.625403 0.625403 Bi\n0.625403 0.625403 0.625403 Bi\n0.625403 0.123793 0.625403 Bi\n0.625403 0.625403 0.123793 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Re",
"Bi"
],
"chemical_system": "Be-Bi-Re",
"density": 9.287524582540527,
"density_atomic": 0.0325449917278208,
"volume": 184.3601636214568,
"volume_molar": 18.504047597750738,
"formula_full": "Be1 Re1 Bi4",
"formula_reduced": "BeReBi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.554030216666668,
"spacegroup": 216
}
]
}