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=updated_at&page=703",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=701",
"results": [
{
"id": "jvasp-14598",
"created_at": "2022-09-04T14:36:04.023824Z",
"updated_at": "2022-09-04T14:36:04.023851Z",
"structure_string": "Y2\n1.0\n1.812173 -3.138775 -0.000000\n1.812173 3.138775 -0.000000\n0.000000 -0.000000 5.643741\nY\n2\ndirect\n0.333332 0.666666 0.250000 Y\n0.666666 0.333332 0.750000 Y\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.5988846909608165,
"density_atomic": 0.0311510783121088,
"volume": 64.20323495583702,
"volume_molar": 19.332045907570148,
"formula_full": "Y2",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy_above_hull": 9.999999999621425e-06,
"spacegroup": 194
},
{
"id": "jvasp-68725",
"created_at": "2022-09-04T14:36:04.026344Z",
"updated_at": "2022-09-04T14:36:04.026357Z",
"structure_string": "Be1 Cd1 Cl2\n1.0\n-1.912568 1.912568 6.308289\n1.912568 -1.912568 6.308289\n1.912568 1.912568 -6.308289\nBe Cd Cl\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.750001 0.250000 0.500000 Cd\n0.000000 0.000000 0.000000 Cl\n0.250000 0.750001 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Cl"
],
"chemical_system": "Be-Cd-Cl",
"density": 3.4601022990288466,
"density_atomic": 0.04333658133262839,
"volume": 92.30077401117873,
"volume_molar": 13.896206333806704,
"formula_full": "Be1 Cd1 Cl2",
"formula_reduced": "BeCdCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0717474999999999,
"spacegroup": 119
},
{
"id": "jvasp-98655",
"created_at": "2022-09-04T14:36:04.026744Z",
"updated_at": "2022-09-04T14:36:04.026763Z",
"structure_string": "Zn2 Si2 Ag4 O8\n1.0\n5.525459 0.000000 -0.074736\n0.000000 5.487073 0.000000\n-0.042900 0.000000 6.991418\nZn Si Ag O\n2 2 4 8\ndirect\n0.495836 0.808980 0.502225 Zn\n0.995836 0.191019 0.002225 Zn\n0.994392 0.687641 0.254411 Si\n0.494392 0.312359 0.754412 Si\n0.981304 0.199772 0.512347 Ag\n0.481304 0.800228 0.012347 Ag\n0.498569 0.298626 0.243674 Ag\n-0.001431 0.701373 0.743675 Ag\n0.201755 0.289983 0.790895 O\n0.701755 0.710017 0.290895 O\n0.146063 0.795250 0.441915 O\n0.646063 0.204750 0.941915 O\n0.571913 0.600406 0.723727 O\n0.562167 0.156290 0.559803 O\n0.071913 0.399594 0.223727 O\n0.062167 0.843710 0.059803 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"Si",
"Ag",
"O"
],
"chemical_system": "Ag-O-Si-Zn",
"density": 5.848110517154472,
"density_atomic": 0.07548865046803503,
"volume": 211.95239152904253,
"volume_molar": 7.977544601290786,
"formula_full": "Zn2 Si2 Ag4 O8",
"formula_reduced": "ZnSi(AgO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.35736094,
"spacegroup": 7
},
{
"id": "jvasp-74961",
"created_at": "2022-09-04T14:36:04.044282Z",
"updated_at": "2022-09-04T14:36:04.044311Z",
"structure_string": "Zr1 Be2 Ni1\n1.0\n-2.071248 2.071248 2.929920\n2.071248 -2.071248 2.929920\n2.071248 2.071248 -2.929920\nZr Be Ni\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Zr\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"Ni"
],
"chemical_system": "Be-Ni-Zr",
"density": 5.546612808557784,
"density_atomic": 0.07955729960272916,
"volume": 50.27822739049809,
"volume_molar": 7.569564062721674,
"formula_full": "Zr1 Be2 Ni1",
"formula_reduced": "ZrBe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.202442275,
"spacegroup": 216
},
{
"id": "jvasp-70407",
"created_at": "2022-09-04T14:36:04.047248Z",
"updated_at": "2022-09-04T14:36:04.047276Z",
"structure_string": "Hf1 Be1 Sb1\n1.0\n1.593366 -2.759792 -0.000000\n1.593366 2.759792 0.000000\n0.000000 0.000000 6.730551\nHf Be Sb\n1 1 1\ndirect\n0.333334 0.666668 0.687785 Hf\n0.000000 0.000000 0.997197 Be\n0.666668 0.333334 0.315018 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Sb"
],
"chemical_system": "Be-Hf-Sb",
"density": 8.675677526108416,
"density_atomic": 0.050681416263804874,
"volume": 59.19329452800846,
"volume_molar": 11.882345056526825,
"formula_full": "Hf1 Be1 Sb1",
"formula_reduced": "HfBeSb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7678217333333333,
"spacegroup": 156
},
{
"id": "jvasp-75712",
"created_at": "2022-09-04T14:36:04.053097Z",
"updated_at": "2022-09-04T14:36:04.053124Z",
"structure_string": "Na1 As1 Ir2\n1.0\n0.000000 3.174156 3.174156\n3.174156 0.000000 3.174156\n3.174156 3.174156 0.000000\nNa As Ir\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Na\n0.500001 0.500001 0.500001 As\n0.000000 0.000000 0.000000 Ir\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"As",
"Ir"
],
"chemical_system": "As-Ir-Na",
"density": 12.522539599872042,
"density_atomic": 0.06253817365903867,
"volume": 63.960934033798374,
"volume_molar": 9.62954369731521,
"formula_full": "Na1 As1 Ir2",
"formula_reduced": "NaAsIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8024232375,
"spacegroup": 216
},
{
"id": "jvasp-90774",
"created_at": "2022-09-04T14:36:04.053338Z",
"updated_at": "2022-09-04T14:36:04.053370Z",
"structure_string": "Zr6 Sn2\n1.0\n5.159215 0.000000 0.000000\n0.000000 6.089579 0.000000\n0.000000 0.000000 5.718808\nZr Sn\n6 2\ndirect\n0.000000 0.250018 0.647227 Zr\n0.000000 0.500000 0.136290 Zr\n0.000000 0.749982 0.647227 Zr\n0.500000 0.000000 0.863710 Zr\n0.500000 0.249982 0.352773 Zr\n0.500000 0.750018 0.352773 Zr\n0.000000 0.000000 0.162398 Sn\n0.500000 0.500000 0.837603 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.252901142359848,
"density_atomic": 0.04452598907467721,
"volume": 179.67034907596818,
"volume_molar": 13.525001656672703,
"formula_full": "Zr6 Sn2",
"formula_reduced": "Zr3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 3.2491413,
"spacegroup": 59
},
{
"id": "jvasp-14817",
"created_at": "2022-09-04T14:36:04.057814Z",
"updated_at": "2022-09-04T14:36:04.057837Z",
"structure_string": "Rh1\n1.0\n2.346718 0.000000 1.354878\n0.782239 2.212506 1.354878\n0.000000 0.000000 2.709755\nRh\n1\ndirect\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rh"
],
"chemical_system": "Rh",
"density": 12.145413259514248,
"density_atomic": 0.07107626731558694,
"volume": 14.06939387460913,
"volume_molar": 8.472787032077798,
"formula_full": "Rh1",
"formula_reduced": "Rh",
"formula_anonymous": "A",
"energy_above_hull": 2.9999999999752447e-06,
"spacegroup": 225
},
{
"id": "jvasp-66618",
"created_at": "2022-09-04T14:36:04.057978Z",
"updated_at": "2022-09-04T14:36:04.058010Z",
"structure_string": "K1 Ba1 Se1\n1.0\n0.000000 3.933249 3.933249\n3.933249 -0.000000 3.933249\n3.933249 3.933249 0.000000\nK Ba Se\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Se"
],
"chemical_system": "Ba-K-Se",
"density": 3.4846621221991265,
"density_atomic": 0.02465113592071525,
"volume": 121.69824585969647,
"volume_molar": 24.42946556040598,
"formula_full": "K1 Ba1 Se1",
"formula_reduced": "KBaSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.099691556111111,
"spacegroup": 216
},
{
"id": "jvasp-67214",
"created_at": "2022-09-04T14:36:04.058238Z",
"updated_at": "2022-09-04T14:36:04.058262Z",
"structure_string": "Hf1 Mn1 Be1\n1.0\n-1.547428 1.547428 4.227295\n1.547428 -1.547428 4.227295\n1.547428 1.547428 -4.227295\nHf Mn Be\n1 1 1\ndirect\n0.332166 0.332166 0.000000 Hf\n0.641047 0.641047 0.000000 Mn\n0.026787 0.026787 0.000000 Be\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Hf",
"Mn",
"Be"
],
"chemical_system": "Be-Hf-Mn",
"density": 9.942837240108558,
"density_atomic": 0.07409310679419047,
"volume": 40.48959653336099,
"volume_molar": 8.127801654650263,
"formula_full": "Hf1 Mn1 Be1",
"formula_reduced": "HfMnBe",
"formula_anonymous": "ABC",
"energy_above_hull": 3.40974878045977,
"spacegroup": 107
},
{
"id": "jvasp-14887",
"created_at": "2022-09-04T14:36:04.058274Z",
"updated_at": "2022-09-04T14:36:04.058296Z",
"structure_string": "Sb4 Ru4\n1.0\n3.892083 0.000000 0.000000\n0.000000 5.902137 0.000000\n0.000000 0.000000 6.625222\nSb Ru\n4 4\ndirect\n0.750000 0.797604 0.585581 Sb\n0.250000 0.202396 0.414419 Sb\n0.750000 0.297604 0.914419 Sb\n0.250000 0.702396 0.085581 Sb\n0.750000 0.994985 0.207652 Ru\n0.250000 0.005016 0.792348 Ru\n0.750000 0.494985 0.292348 Ru\n0.250000 0.505016 0.707652 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sb",
"Ru"
],
"chemical_system": "Ru-Sb",
"density": 9.725029658598666,
"density_atomic": 0.05256518199478966,
"volume": 152.19199661085491,
"volume_molar": 11.45652032670014,
"formula_full": "Sb4 Ru4",
"formula_reduced": "SbRu",
"formula_anonymous": "AB",
"energy_above_hull": 2.0035983000000006,
"spacegroup": 62
},
{
"id": "jvasp-90496",
"created_at": "2022-09-04T14:36:04.060427Z",
"updated_at": "2022-09-04T14:36:04.060446Z",
"structure_string": "Mn6 P3\n1.0\n6.085981 -0.000000 0.000000\n-3.042992 5.270615 -0.000000\n-0.000000 0.000000 3.273728\nMn P\n6 3\ndirect\n0.256502 0.256501 0.000000 Mn\n0.743498 0.000000 0.000000 Mn\n0.599205 0.599205 0.500000 Mn\n-0.000000 0.743498 0.000000 Mn\n0.400794 0.000000 0.500000 Mn\n-0.000000 0.400794 0.500000 Mn\n0.333333 0.666666 0.000004 P\n0.000000 0.000000 0.500000 P\n0.666667 0.333333 0.999997 P\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mn",
"P"
],
"chemical_system": "Mn-P",
"density": 6.6817814793037495,
"density_atomic": 0.08570536931022224,
"volume": 105.01092373131578,
"volume_molar": 7.0265618227512014,
"formula_full": "Mn6 P3",
"formula_reduced": "Mn2P",
"formula_anonymous": "AB2",
"energy_above_hull": 3.245913327586207,
"spacegroup": 189
}
]
}