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=87",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=85",
"results": [
{
"id": "jvasp-66505",
"created_at": "2022-09-04T14:36:09.619904Z",
"updated_at": "2022-09-04T14:36:09.619936Z",
"structure_string": "Ba1 Mg1 Te1\n1.0\n-0.000000 4.041344 4.041344\n4.041344 0.000000 4.041344\n4.041344 4.041344 0.000000\nBa Mg Te\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.499999 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Te"
],
"chemical_system": "Ba-Mg-Te",
"density": 3.6382118556168597,
"density_atomic": 0.022725518528513886,
"volume": 132.01018917284006,
"volume_molar": 26.49946469843569,
"formula_full": "Ba1 Mg1 Te1",
"formula_reduced": "BaMgTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-64339",
"created_at": "2022-09-04T14:36:03.562685Z",
"updated_at": "2022-09-04T14:36:03.562729Z",
"structure_string": "Ba4 Zn1 Ga1\n1.0\n-0.000000 5.026546 5.026546\n5.026546 0.000000 5.026546\n5.026546 5.026546 -0.000000\nBa Zn Ga\n4 1 1\ndirect\n0.126217 0.624595 0.624595 Ba\n0.624595 0.624595 0.624595 Ba\n0.624595 0.126217 0.624595 Ba\n0.624595 0.624595 0.126217 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Ga"
],
"chemical_system": "Ba-Ga-Zn",
"density": 4.474510179836045,
"density_atomic": 0.023621760982120498,
"volume": 254.0030781168876,
"volume_molar": 25.494038164886213,
"formula_full": "Ba4 Zn1 Ga1",
"formula_reduced": "Ba4ZnGa",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-66606",
"created_at": "2022-09-04T14:35:40.719381Z",
"updated_at": "2022-09-04T14:35:40.719402Z",
"structure_string": "Ba1 Ga1 Br1\n1.0\n-0.000000 3.929240 3.929240\n3.929240 0.000000 3.929240\n3.929240 3.929240 -0.000000\nBa Ga Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"Br"
],
"chemical_system": "Ba-Br-Ga",
"density": 3.9274052390511716,
"density_atomic": 0.02472666752786267,
"volume": 121.32649887493007,
"volume_molar": 24.35484180476035,
"formula_full": "Ba1 Ga1 Br1",
"formula_reduced": "BaGaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-7716",
"created_at": "2022-09-04T14:36:59.374719Z",
"updated_at": "2022-09-04T14:36:59.374741Z",
"structure_string": "Yb3 Tl3 Pd3\n1.0\n3.879118 -6.718828 0.000000\n3.879118 6.718828 -0.000000\n0.000000 -0.000000 3.880755\nYb Tl Pd\n3 3 3\ndirect\n0.397996 0.397996 0.500001 Yb\n0.000000 0.602004 0.500001 Yb\n0.602004 0.000000 0.500001 Yb\n0.000000 0.269624 0.000000 Tl\n0.269624 0.000000 0.000000 Tl\n0.730377 0.730377 0.000000 Tl\n0.000000 0.000000 0.500001 Pd\n0.333333 0.666667 0.000000 Pd\n0.666667 0.333333 0.000000 Pd\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Yb",
"Tl",
"Pd"
],
"chemical_system": "Pd-Tl-Yb",
"density": 11.915227757234033,
"density_atomic": 0.0444907548164785,
"volume": 202.28921799875997,
"volume_molar": 13.535712722431757,
"formula_full": "Yb3 Tl3 Pd3",
"formula_reduced": "YbTlPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-65158",
"created_at": "2022-09-04T14:36:03.817265Z",
"updated_at": "2022-09-04T14:36:03.817299Z",
"structure_string": "Be1 Tl1 Cu4\n1.0\n0.000000 3.489133 3.489133\n3.489133 0.000000 3.489133\n3.489133 3.489133 -0.000000\nBe Tl Cu\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tl\n0.122058 0.625980 0.625980 Cu\n0.625980 0.625980 0.625980 Cu\n0.625980 0.122058 0.625980 Cu\n0.625980 0.625980 0.122058 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Cu"
],
"chemical_system": "Be-Cu-Tl",
"density": 9.139490257616997,
"density_atomic": 0.07062666213190075,
"volume": 84.9537528588642,
"volume_molar": 8.526724296772212,
"formula_full": "Be1 Tl1 Cu4",
"formula_reduced": "BeTlCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-15490",
"created_at": "2022-09-04T14:35:48.378248Z",
"updated_at": "2022-09-04T14:35:48.378275Z",
"structure_string": "Lu1 In1 Cu2\n1.0\n4.006323 0.000000 2.313052\n1.335441 3.777198 2.313052\n-0.000000 -0.000000 4.626103\nLu In Cu\n1 1 2\ndirect\n0.499999 0.500000 0.499999 Lu\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Cu\n0.749999 0.750000 0.749999 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"In",
"Cu"
],
"chemical_system": "Cu-In-Lu",
"density": 9.888399929542981,
"density_atomic": 0.05713851931141406,
"volume": 70.00531424693315,
"volume_molar": 10.539546408576621,
"formula_full": "Lu1 In1 Cu2",
"formula_reduced": "LuInCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107491",
"created_at": "2022-09-04T14:36:59.568106Z",
"updated_at": "2022-09-04T14:36:59.568136Z",
"structure_string": "Rb3 Fe1 F6\n1.0\n5.500984 0.142840 -3.405082\n-1.636310 5.253924 -3.405082\n-0.102289 -0.142840 6.468767\nRb Fe F\n3 1 6\ndirect\n0.749999 0.250000 0.500000 Rb\n0.250000 0.749999 0.500000 Rb\n0.499999 0.500000 -0.000000 Rb\n0.000000 0.000000 0.000000 Fe\n-0.000000 0.297683 0.297683 F\n-0.000000 0.702316 0.702317 F\n0.297683 0.000000 0.297683 F\n0.702316 0.000000 0.702317 F\n0.206129 0.206130 -0.000000 F\n0.793870 0.793870 -0.000000 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Fe",
"F"
],
"chemical_system": "F-Fe-Rb",
"density": 3.8630613474621853,
"density_atomic": 0.05457949430940066,
"volume": 183.21899325984816,
"volume_molar": 11.03370567316297,
"formula_full": "Rb3 Fe1 F6",
"formula_reduced": "Rb3FeF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-104624",
"created_at": "2022-09-04T14:36:31.083326Z",
"updated_at": "2022-09-04T14:36:31.083342Z",
"structure_string": "Yb1 Dy1 Cd2\n1.0\n4.557992 -0.000000 2.631558\n1.519331 4.297316 2.631558\n-0.000000 -0.000000 5.263116\nYb Dy Cd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500001 Dy\n0.749999 0.750001 0.750001 Cd\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Dy",
"Cd"
],
"chemical_system": "Cd-Dy-Yb",
"density": 9.026179857431066,
"density_atomic": 0.03880129319640604,
"volume": 103.08934755737727,
"volume_molar": 15.520464046177203,
"formula_full": "Yb1 Dy1 Cd2",
"formula_reduced": "YbDyCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-98515",
"created_at": "2022-09-04T14:36:15.113820Z",
"updated_at": "2022-09-04T14:36:15.113838Z",
"structure_string": "Li4 In4 I16\n1.0\n7.378171 0.000000 0.000000\n0.000000 8.285769 -0.380507\n0.000000 0.008632 14.979684\nLi In I\n4 4 16\ndirect\n0.015219 0.140315 0.375501 Li\n0.515219 0.859685 0.124498 Li\n0.984781 0.859685 0.624498 Li\n0.484781 0.140315 0.875501 Li\n0.173499 0.307556 0.600499 In\n0.673499 0.692443 0.899500 In\n0.826501 0.692443 0.399501 In\n0.326501 0.307557 0.100499 In\n0.681400 0.410186 0.796915 I\n0.181400 0.589814 0.703084 I\n0.168489 0.054098 0.189680 I\n0.668489 0.945902 0.310319 I\n0.831511 0.945902 0.810319 I\n0.331511 0.054098 0.689680 I\n0.330174 0.821215 0.939282 I\n0.167474 0.320127 0.934403 I\n0.669826 0.178785 0.060718 I\n0.169826 0.821215 0.439282 I\n0.818599 0.410186 0.296915 I\n0.667474 0.679873 0.565596 I\n0.832526 0.679873 0.065596 I\n0.332526 0.320127 0.434403 I\n0.830174 0.178785 0.560718 I\n0.318599 0.589814 0.203085 I\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"In",
"I"
],
"chemical_system": "I-In-Li",
"density": 4.564825618817146,
"density_atomic": 0.026206894442202186,
"volume": 915.7895474006137,
"volume_molar": 22.979223170763284,
"formula_full": "Li4 In4 I16",
"formula_reduced": "LiInI4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-93854",
"created_at": "2022-09-04T14:36:31.311240Z",
"updated_at": "2022-09-04T14:36:31.311270Z",
"structure_string": "Yb2 Al2 Ga2\n1.0\n-2.240839 -3.881171 -0.000000\n-2.240839 3.881171 0.000000\n0.000000 -0.000000 -7.346487\nYb Al Ga\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Yb\n0.000000 0.000000 0.000000 Yb\n0.666674 0.333326 0.750000 Al\n0.333326 0.666674 0.250000 Al\n0.666667 0.333333 0.250000 Ga\n0.333333 0.666667 0.750000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Al",
"Ga"
],
"chemical_system": "Al-Ga-Yb",
"density": 7.010493829712379,
"density_atomic": 0.04695351484038808,
"volume": 127.7859606548341,
"volume_molar": 12.825750703587213,
"formula_full": "Yb2 Al2 Ga2",
"formula_reduced": "YbAlGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-69026",
"created_at": "2022-09-04T14:36:15.156598Z",
"updated_at": "2022-09-04T14:36:15.156626Z",
"structure_string": "Ba2 Sn1 Hg1\n1.0\n0.000000 4.210520 4.210520\n4.210520 0.000000 4.210520\n4.210520 4.210520 -0.000000\nBa Sn Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Hg"
],
"chemical_system": "Ba-Hg-Sn",
"density": 6.606397625830391,
"density_atomic": 0.026793089318721087,
"volume": 149.2922280225852,
"volume_molar": 22.476470288150608,
"formula_full": "Ba2 Sn1 Hg1",
"formula_reduced": "Ba2SnHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-9087",
"created_at": "2022-09-04T14:37:32.847301Z",
"updated_at": "2022-09-04T14:37:32.847320Z",
"structure_string": "Cd8 Sb8\n1.0\n6.618534 -0.000000 0.000000\n0.000000 8.371657 0.000000\n0.000000 0.000000 8.666078\nCd Sb\n8 8\ndirect\n0.450024 0.122808 0.866656 Cd\n0.950024 0.377192 0.133344 Cd\n0.549975 0.622808 0.633344 Cd\n0.049976 0.877192 0.366656 Cd\n0.549975 0.877192 0.133344 Cd\n0.049976 0.622808 0.866656 Cd\n0.450024 0.377192 0.366656 Cd\n0.950024 0.122808 0.633344 Cd\n0.139408 0.074156 0.104181 Sb\n0.639408 0.425844 0.895820 Sb\n0.860592 0.574156 0.395820 Sb\n0.360592 0.925844 0.604181 Sb\n0.860592 0.925844 0.895820 Sb\n0.360592 0.574156 0.104181 Sb\n0.139408 0.425844 0.604181 Sb\n0.639408 0.074156 0.395820 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Cd",
"Sb"
],
"chemical_system": "Cd-Sb",
"density": 6.478528458681743,
"density_atomic": 0.03332147047186024,
"volume": 480.17088602112847,
"volume_molar": 18.0728541529572,
"formula_full": "Cd8 Sb8",
"formula_reduced": "CdSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 61
}
]
}