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=-formula_reduced&page=3554",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3552",
"results": [
{
"id": "jvasp-63443",
"created_at": "2022-09-04T14:36:04.550253Z",
"updated_at": "2022-09-04T14:36:04.550278Z",
"structure_string": "Cr10 B6\n1.0\n-2.719074 2.719074 4.974006\n2.719074 -2.719074 4.974006\n2.719074 2.719074 -4.974006\nCr B\n10 6\ndirect\n0.025135 0.525134 0.843189 Cr\n0.681946 0.181946 0.156810 Cr\n0.181945 0.025135 0.499999 Cr\n0.525136 0.681946 0.499999 Cr\n0.474864 0.318054 0.499999 Cr\n0.818054 0.974864 0.499999 Cr\n0.318054 0.818053 0.843189 Cr\n0.974864 0.474865 0.156810 Cr\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cr\n0.750001 0.750001 0.000000 B\n0.250000 0.250000 0.000000 B\n0.382715 0.882714 0.265427 B\n0.617285 0.117286 0.734572 B\n0.117286 0.382714 0.499999 B\n0.882714 0.617286 0.499999 B\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Cr",
"B"
],
"chemical_system": "B-Cr",
"density": 6.601888143445875,
"density_atomic": 0.10877062706159728,
"volume": 147.09853599482452,
"volume_molar": 5.536550558442249,
"formula_full": "Cr10 B6",
"formula_reduced": "Cr5B3",
"formula_anonymous": "A3B5",
"energy_above_hull": 5.392494343750001,
"spacegroup": 140
},
{
"id": "jvasp-109407",
"created_at": "2022-09-04T14:38:27.651969Z",
"updated_at": "2022-09-04T14:38:27.651992Z",
"structure_string": "Cr4 Te3 Se1\n1.0\n4.024893 0.000000 0.000000\n-2.012447 3.485659 0.000000\n-0.000000 -0.000000 12.539463\nCr Te Se\n4 3 1\ndirect\n0.000000 0.000000 0.116831 Cr\n0.000000 0.000000 0.627673 Cr\n0.000000 0.000000 0.372327 Cr\n0.000000 0.000000 0.883169 Cr\n0.666666 0.333333 0.500000 Te\n0.333333 0.666667 0.244371 Te\n0.333333 0.666667 0.755628 Te\n0.666666 0.333333 -0.000000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Te",
"Se"
],
"chemical_system": "Cr-Se-Te",
"density": 6.321789236791968,
"density_atomic": 0.04547490613096056,
"volume": 175.92119875874536,
"volume_molar": 13.242777769913774,
"formula_full": "Cr4 Te3 Se1",
"formula_reduced": "Cr4Te3Se",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.3851495333333337,
"spacegroup": 187
},
{
"id": "jvasp-106824",
"created_at": "2022-09-04T14:36:58.538648Z",
"updated_at": "2022-09-04T14:36:58.538671Z",
"structure_string": "Cr4 Te3 S1\n1.0\n6.022274 -0.014486 -4.244387\n-0.575144 3.764200 -6.307362\n0.027807 0.014486 7.367620\nCr Te S\n4 3 1\ndirect\n0.094048 0.122495 0.971554 Cr\n0.645258 0.615473 0.029785 Cr\n0.414312 0.384526 0.029785 Cr\n0.849059 0.877507 0.971553 Cr\n0.160696 0.500001 0.660696 Te\n0.095962 0.761999 0.333964 Te\n0.571965 0.238002 0.333962 Te\n0.675949 0.000000 0.675949 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Te",
"S"
],
"chemical_system": "Cr-S-Te",
"density": 6.15678614279499,
"density_atomic": 0.047622468987131614,
"volume": 167.98793028059367,
"volume_molar": 12.645587026635019,
"formula_full": "Cr4 Te3 S1",
"formula_reduced": "Cr4Te3S",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.4552316125,
"spacegroup": 44
},
{
"id": "jvasp-121353",
"created_at": "2022-09-04T14:38:54.026311Z",
"updated_at": "2022-09-04T14:38:54.026334Z",
"structure_string": "Cr8 Se6 N4\n1.0\n6.431853 -0.000000 0.000000\n0.000000 13.072720 0.000000\n-0.000000 -0.000000 3.353242\nCr Se N\n8 6 4\ndirect\n0.687284 0.938249 0.500000 Cr\n0.312715 0.061751 0.500000 Cr\n0.187285 0.561751 -0.000000 Cr\n0.812715 0.438249 -0.000000 Cr\n0.803779 0.642750 0.500000 Cr\n0.196221 0.357250 0.500000 Cr\n0.303779 0.857250 -0.000000 Cr\n0.696221 0.142750 -0.000000 Cr\n0.665512 0.782704 -0.000000 Se\n0.334487 0.217296 -0.000000 Se\n0.165512 0.717296 0.500000 Se\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n0.834487 0.282704 0.500000 Se\n0.114308 0.420911 -0.000000 N\n0.614308 0.079089 0.500000 N\n0.385692 0.920911 0.500000 N\n0.885691 0.579089 -0.000000 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Cr",
"Se",
"N"
],
"chemical_system": "Cr-N-Se",
"density": 5.570075123100397,
"density_atomic": 0.06384186105164852,
"volume": 281.9466679619172,
"volume_molar": 9.432902895998042,
"formula_full": "Cr8 Se6 N4",
"formula_reduced": "Cr4Se3N2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.387412911111111,
"spacegroup": 58
},
{
"id": "jvasp-109808",
"created_at": "2022-09-04T14:38:16.271132Z",
"updated_at": "2022-09-04T14:38:16.271159Z",
"structure_string": "Cr4 S3 N2\n1.0\n4.647020 -0.001547 3.525306\n1.054717 2.946361 0.000000\n0.031894 -0.011417 8.448320\nCr S N\n4 3 2\ndirect\n0.317640 0.841178 0.643434 Cr\n0.682360 0.158819 0.356567 Cr\n0.545606 0.727197 0.109865 Cr\n0.454394 0.272801 0.890136 Cr\n0.000000 0.000000 0.000000 S\n0.826269 0.586864 0.765261 S\n0.173732 0.413134 0.234739 S\n0.488801 0.755598 0.364527 N\n0.511199 0.244400 0.635473 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Cr",
"S",
"N"
],
"chemical_system": "Cr-N-S",
"density": 4.783678422733056,
"density_atomic": 0.07804861014448779,
"volume": 115.31275167281923,
"volume_molar": 7.715884688851587,
"formula_full": "Cr4 S3 N2",
"formula_reduced": "Cr4S3N2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.565768455555554,
"spacegroup": 12
},
{
"id": "jvasp-48414",
"created_at": "2022-09-04T14:36:14.454702Z",
"updated_at": "2022-09-04T14:36:14.454712Z",
"structure_string": "Cr4 O1 F11\n1.0\n4.862703 -0.002951 -0.002100\n-0.077099 5.236602 -0.087826\n-0.008532 -0.594874 7.178268\nCr O F\n4 1 11\ndirect\n0.501981 0.499825 0.499468 Cr\n0.481818 0.486662 0.001541 Cr\n0.001506 0.000068 0.499440 Cr\n0.011979 0.016371 0.002231 Cr\n0.185573 0.313316 0.066082 O\n0.142610 0.995287 0.749331 F\n0.178694 0.677795 0.430684 F\n0.326429 0.175585 0.427293 F\n0.314374 0.815229 0.069201 F\n0.360122 0.496615 0.748881 F\n0.637740 0.501931 0.249067 F\n0.684309 0.182035 0.927306 F\n0.677510 0.823716 0.571729 F\n0.824842 0.322229 0.568982 F\n0.807789 0.690179 0.938680 F\n0.862722 0.003162 0.250086 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cr",
"O",
"F"
],
"chemical_system": "Cr-F-O",
"density": 3.938805436107336,
"density_atomic": 0.08765594669425142,
"volume": 182.53182588751048,
"volume_molar": 6.870202179215,
"formula_full": "Cr4 O1 F11",
"formula_reduced": "Cr4OF11",
"formula_anonymous": "AB4C11",
"energy_above_hull": 1.38867413796875,
"spacegroup": 1
},
{
"id": "jvasp-42934",
"created_at": "2022-09-04T14:38:11.034671Z",
"updated_at": "2022-09-04T14:38:11.034705Z",
"structure_string": "Cr4 O1 F11\n1.0\n-4.910038 0.000000 0.000000\n-2.455019 -4.626727 -0.066111\n0.000000 -2.570379 8.015277\nCr O F\n4 1 11\ndirect\n0.744930 0.517850 0.258999 Cr\n0.512779 0.982151 0.491002 Cr\n0.250961 0.496118 0.748731 Cr\n0.997078 0.003882 0.001269 Cr\n0.759992 0.750001 0.375000 O\n0.805226 0.747273 0.691964 F\n0.802499 0.752728 0.058037 F\n0.738347 0.257828 0.126668 F\n0.695622 0.249477 0.805215 F\n0.691887 0.249419 0.443654 F\n0.303165 0.749079 0.553091 F\n0.302244 0.750922 0.196909 F\n0.262698 0.750001 0.875000 F\n0.246175 0.242172 0.623332 F\n0.191304 0.250581 0.306346 F\n0.195097 0.250523 0.944786 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cr",
"O",
"F"
],
"chemical_system": "Cr-F-O",
"density": 3.9304326978331705,
"density_atomic": 0.08746961601309686,
"volume": 182.92066124543538,
"volume_molar": 6.884837312076805,
"formula_full": "Cr4 O1 F11",
"formula_reduced": "Cr4OF11",
"formula_anonymous": "AB4C11",
"energy_above_hull": 1.38845101296875,
"spacegroup": 5
},
{
"id": "jvasp-23483",
"created_at": "2022-09-04T14:37:32.900272Z",
"updated_at": "2022-09-04T14:37:32.900312Z",
"structure_string": "Cr4 In1 Cu1 Se8\n1.0\n6.334315 -0.000000 3.657119\n2.111439 5.972049 3.657119\n-0.000000 -0.000000 7.314236\nCr In Cu Se\n4 1 1 8\ndirect\n0.192874 0.602375 0.602375 Cr\n0.602376 0.602375 0.192874 Cr\n0.602376 0.192874 0.602375 Cr\n0.602376 0.602375 0.602375 Cr\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Cu\n0.377317 0.377316 0.377316 Se\n0.856589 0.430236 0.856589 Se\n0.856589 0.856588 0.430236 Se\n0.856589 0.856588 0.856589 Se\n0.868052 0.377316 0.377316 Se\n0.377317 0.868052 0.377316 Se\n0.430237 0.856588 0.856589 Se\n0.377317 0.377316 0.868052 Se\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cr",
"In",
"Cu",
"Se"
],
"chemical_system": "Cr-Cu-In-Se",
"density": 6.10965944276973,
"density_atomic": 0.050598314194213456,
"volume": 276.6890601584721,
"volume_molar": 11.901860478760193,
"formula_full": "Cr4 In1 Cu1 Se8",
"formula_reduced": "Cr4InCuSe8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.5676397823809527,
"spacegroup": 216
},
{
"id": "jvasp-112373",
"created_at": "2022-09-04T14:38:39.668629Z",
"updated_at": "2022-09-04T14:38:39.668637Z",
"structure_string": "Cr4 In1 Cu1 S8\n1.0\n6.181339 0.016893 3.744031\n2.117736 5.807273 3.744031\n0.024072 0.016893 7.226766\nCr In Cu S\n4 1 1 8\ndirect\n0.371769 0.371768 0.371769 Cr\n0.508390 0.996915 0.996917 Cr\n0.996917 0.996915 0.508389 Cr\n0.996917 0.508388 0.996917 Cr\n0.997103 0.997100 0.997102 In\n0.628720 0.628719 0.628720 Cu\n0.233131 0.744241 0.744243 S\n0.744243 0.744241 0.233130 S\n0.744243 0.233129 0.744243 S\n0.758824 0.758822 0.758824 S\n0.767673 0.255689 0.255690 S\n0.255690 0.255689 0.767673 S\n0.255691 0.767671 0.255690 S\n0.240700 0.240700 0.240700 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cr",
"In",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-In-S",
"density": 4.131546232283624,
"density_atomic": 0.05418380210662252,
"volume": 258.37980089420256,
"volume_molar": 11.114282360897583,
"formula_full": "Cr4 In1 Cu1 S8",
"formula_reduced": "Cr4InCuS8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.901205715714286,
"spacegroup": 160
},
{
"id": "jvasp-116706",
"created_at": "2022-09-04T14:38:43.998609Z",
"updated_at": "2022-09-04T14:38:43.998625Z",
"structure_string": "Cr4 In1 Ag1 Se8\n1.0\n6.619830 0.000000 3.821961\n2.206610 6.241236 3.821961\n-0.000000 -0.000000 7.643921\nCr In Ag Se\n4 1 1 8\ndirect\n0.379082 0.379082 0.379082 Cr\n0.379082 0.862754 0.379081 Cr\n0.862753 0.379082 0.379082 Cr\n0.379082 0.379082 0.862753 Cr\n0.000000 0.000000 0.000000 In\n0.750000 0.750001 0.750000 Ag\n0.140307 0.140307 0.140307 Se\n0.140307 0.579077 0.140307 Se\n0.579077 0.140307 0.140307 Se\n0.140307 0.140307 0.579077 Se\n0.610986 0.610986 0.610985 Se\n0.610986 0.167044 0.610985 Se\n0.167044 0.610986 0.610985 Se\n0.610986 0.610986 0.167044 Se\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cr",
"In",
"Ag",
"Se"
],
"chemical_system": "Ag-Cr-In-Se",
"density": 5.585773655508156,
"density_atomic": 0.04432966038333518,
"volume": 315.81563853493924,
"volume_molar": 13.584901639047743,
"formula_full": "Cr4 In1 Ag1 Se8",
"formula_reduced": "Cr4InAgSe8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.570563125952382,
"spacegroup": 216
},
{
"id": "jvasp-113108",
"created_at": "2022-09-04T14:38:47.127816Z",
"updated_at": "2022-09-04T14:38:47.127842Z",
"structure_string": "Cr4 Ga1 Cu1 S8\n1.0\n6.098640 -0.000000 3.521051\n2.032880 5.749853 3.521051\n-0.000000 -0.000000 7.042103\nCr Ga Cu S\n4 1 1 8\ndirect\n0.636312 0.121230 0.121230 Cr\n0.121230 0.636311 0.121230 Cr\n0.121230 0.121230 0.636311 Cr\n0.121230 0.121230 0.121230 Cr\n0.500000 0.500000 0.500000 Ga\n0.750000 0.750000 0.750000 Cu\n0.349667 0.883444 0.883444 S\n0.883444 0.349667 0.883444 S\n0.883445 0.883444 0.349666 S\n0.883445 0.883444 0.883444 S\n0.904037 0.365320 0.365320 S\n0.365321 0.904037 0.365320 S\n0.365321 0.365320 0.904037 S\n0.365321 0.365320 0.365320 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cr",
"Ga",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-Ga-S",
"density": 4.0196993409306225,
"density_atomic": 0.05669384645295441,
"volume": 246.94038023363711,
"volume_molar": 10.622212350677746,
"formula_full": "Cr4 Ga1 Cu1 S8",
"formula_reduced": "Cr4GaCuS8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.8972265982142864,
"spacegroup": 216
},
{
"id": "jvasp-58334",
"created_at": "2022-09-04T14:37:42.749559Z",
"updated_at": "2022-09-04T14:37:42.749583Z",
"structure_string": "Cr4 Fe1 Cu1 S8\n1.0\n5.992025 0.000000 3.459497\n1.997342 5.649336 3.459497\n0.000000 0.000000 6.918995\nCr Fe Cu S\n4 1 1 8\ndirect\n0.624235 0.624235 0.624235 Cr\n0.624235 0.624235 0.127295 Cr\n0.624235 0.127295 0.624235 Cr\n0.127294 0.624235 0.624235 Cr\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Cu\n0.871590 0.385233 0.871590 S\n0.385233 0.871590 0.871590 S\n0.871590 0.871590 0.385233 S\n0.871590 0.871590 0.871590 S\n0.383024 0.850930 0.383024 S\n0.850930 0.383024 0.383024 S\n0.383024 0.383024 0.383024 S\n0.383024 0.383024 0.850930 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cr",
"Fe",
"Cu",
"S"
],
"chemical_system": "Cr-Cu-Fe-S",
"density": 4.139711847378168,
"density_atomic": 0.05977423086928361,
"volume": 234.2146405968099,
"volume_molar": 10.074810955191428,
"formula_full": "Cr4 Fe1 Cu1 S8",
"formula_reduced": "Cr4FeCuS8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 3.2480468250000003,
"spacegroup": 216
}
]
}