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=158",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=156",
"results": [
{
"id": "jvasp-14792",
"created_at": "2022-09-04T14:35:58.261398Z",
"updated_at": "2022-09-04T14:35:58.261417Z",
"structure_string": "Ta4 Co2\n1.0\n4.311689 0.000000 2.478946\n2.155844 4.324930 1.239473\n0.000171 -0.000000 4.988885\nTa Co\n4 2\ndirect\n0.160723 0.500000 0.178554 Ta\n0.339276 0.821446 0.500000 Ta\n0.660723 0.178554 0.500000 Ta\n0.839276 0.500000 0.821446 Ta\n0.250000 -0.000000 0.000000 Co\n0.750000 -0.000000 0.000001 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Co"
],
"chemical_system": "Co-Ta",
"density": 15.023228117708548,
"density_atomic": 0.06449555812458004,
"volume": 93.02966242125328,
"volume_molar": 9.337295365934494,
"formula_full": "Ta4 Co2",
"formula_reduced": "Ta2Co",
"formula_anonymous": "AB2",
"energy_above_hull": 4.857666433333332,
"spacegroup": 140
},
{
"id": "jvasp-35767",
"created_at": "2022-09-04T14:37:34.724918Z",
"updated_at": "2022-09-04T14:37:34.724934Z",
"structure_string": "Pa1 C2\n1.0\n3.622386 0.000000 0.000000\n0.000000 3.622386 0.000000\n-1.811193 -1.811193 3.067031\nPa C\n1 2\ndirect\n0.000000 0.000000 0.000000 Pa\n0.610679 0.610679 0.221356 C\n0.389323 0.389323 0.778644 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pa",
"C"
],
"chemical_system": "C-Pa",
"density": 10.523960331117276,
"density_atomic": 0.07454416179206426,
"volume": 40.24460035338905,
"volume_molar": 8.078621605268488,
"formula_full": "Pa1 C2",
"formula_reduced": "PaC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.857554366666667,
"spacegroup": 139
},
{
"id": "jvasp-39443",
"created_at": "2022-09-04T14:38:01.776809Z",
"updated_at": "2022-09-04T14:38:01.776837Z",
"structure_string": "Os2 Ru6\n1.0\n2.735245 -4.737582 -0.000000\n2.735245 4.737582 -0.000000\n0.000000 -0.000000 4.317300\nOs Ru\n2 6\ndirect\n0.666666 0.333332 0.750000 Os\n0.333332 0.666666 0.250000 Os\n0.833059 0.666120 0.250000 Ru\n0.333878 0.166939 0.250000 Ru\n0.833059 0.166939 0.250000 Ru\n0.166939 0.333878 0.750000 Ru\n0.666120 0.833059 0.750000 Ru\n0.166939 0.833059 0.750000 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Os",
"Ru"
],
"chemical_system": "Os-Ru",
"density": 14.64597366137908,
"density_atomic": 0.07149814768689809,
"volume": 111.89101058999861,
"volume_molar": 8.422792694395278,
"formula_full": "Os2 Ru6",
"formula_reduced": "OsRu3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.857246625,
"spacegroup": 194
},
{
"id": "jvasp-4774",
"created_at": "2022-09-04T14:36:41.796699Z",
"updated_at": "2022-09-04T14:36:41.796724Z",
"structure_string": "Np1 Cr2 Si2\n1.0\n3.571246 -0.000000 -1.361649\n-0.519171 3.533307 -1.361649\n0.241669 0.279774 5.997874\nNp Cr Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.750001 0.250000 0.500000 Cr\n0.250001 0.750000 0.500000 Cr\n0.613776 0.613776 0.227551 Si\n0.386225 0.386224 0.772449 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Np",
"Cr",
"Si"
],
"chemical_system": "Cr-Np-Si",
"density": 8.411626179480233,
"density_atomic": 0.0637722690456173,
"volume": 78.4039845974968,
"volume_molar": 9.443196627819955,
"formula_full": "Np1 Cr2 Si2",
"formula_reduced": "Np(CrSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.8571504,
"spacegroup": 139
},
{
"id": "jvasp-26047",
"created_at": "2022-09-04T14:37:07.389636Z",
"updated_at": "2022-09-04T14:37:07.389655Z",
"structure_string": "Co21 Re2 B6\n1.0\n6.392145 0.000000 3.690507\n2.130715 6.026573 3.690507\n0.000000 0.000000 7.381015\nCo Re B\n21 2 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.661551 -0.000000 0.000001 Co\n-0.000000 -0.000000 0.661552 Co\n0.661551 -0.000000 0.338449 Co\n-0.000000 0.661551 0.000001 Co\n0.661551 0.338449 0.000001 Co\n0.338448 -0.000000 0.661552 Co\n-0.000000 0.661551 0.338450 Co\n-0.000000 0.338449 0.661552 Co\n0.338448 0.661551 0.000001 Co\n-0.000000 0.338449 0.000000 Co\n0.338448 -0.000000 0.000000 Co\n0.381198 0.381198 0.381199 Co\n-0.000000 -0.000000 0.338449 Co\n0.143595 0.618801 0.618803 Co\n0.618801 0.143595 0.618803 Co\n0.618801 0.618801 0.143597 Co\n0.381198 0.856404 0.381200 Co\n0.381198 0.381198 0.856406 Co\n0.618801 0.618801 0.618803 Co\n0.856404 0.381198 0.381200 Co\n0.250000 0.250000 0.250001 Re\n0.749999 0.750000 0.750002 Re\n0.275837 0.724162 0.275839 B\n0.724162 0.275837 0.275838 B\n0.724162 0.724162 0.275839 B\n0.275837 0.275837 0.724163 B\n0.724162 0.275837 0.724164 B\n0.275837 0.724162 0.724164 B\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Co",
"Re",
"B"
],
"chemical_system": "B-Co-Re",
"density": 9.78135256958177,
"density_atomic": 0.10199170933849294,
"volume": 284.3368366712434,
"volume_molar": 5.904539495473648,
"formula_full": "Co21 Re2 B6",
"formula_reduced": "Co21(ReB3)2",
"formula_anonymous": "A2B6C21",
"energy_above_hull": 4.856849668965518,
"spacegroup": 225
},
{
"id": "jvasp-104908",
"created_at": "2022-09-04T14:36:48.661582Z",
"updated_at": "2022-09-04T14:36:48.661597Z",
"structure_string": "V3 Cr3 Si2\n1.0\n4.594563 -0.001533 0.003642\n0.003637 4.594562 0.003642\n-0.001535 -0.001533 4.594565\nV Cr Si\n3 3 2\ndirect\n0.000001 0.749901 0.250099 V\n0.749900 0.250100 -0.000001 V\n0.250100 0.000001 0.749901 V\n0.500000 0.749920 0.250079 Cr\n0.749920 0.250081 0.500000 Cr\n0.250081 0.500000 0.749921 Cr\n0.251251 0.251251 0.251251 Si\n0.748750 0.748750 0.748749 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"V",
"Cr",
"Si"
],
"chemical_system": "Cr-Si-V",
"density": 6.2486991302091015,
"density_atomic": 0.08248156930146072,
"volume": 96.9913650740678,
"volume_molar": 7.301195662257302,
"formula_full": "V3 Cr3 Si2",
"formula_reduced": "V3Cr3Si2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 4.856187749999999,
"spacegroup": 155
},
{
"id": "jvasp-98610",
"created_at": "2022-09-04T14:36:05.500615Z",
"updated_at": "2022-09-04T14:36:05.500644Z",
"structure_string": "Sr4 B16 Ru14\n1.0\n6.473952 0.000000 0.000001\n0.000000 6.473951 0.000000\n0.000001 0.000000 10.199289\nSr B Ru\n4 16 14\ndirect\n0.231142 0.391685 1.000000 Sr\n0.608315 0.231143 0.500000 Sr\n0.391684 0.768857 0.500000 Sr\n0.768856 0.608315 -0.000000 Sr\n0.500000 -0.000000 0.088733 B\n0.224413 0.398382 0.331063 B\n0.224414 0.398381 0.668937 B\n0.000000 0.000000 0.159037 B\n0.000000 -0.000000 0.659038 B\n0.398382 0.775586 0.831063 B\n0.775586 0.601619 0.331063 B\n0.500000 -0.000001 0.911267 B\n0.775586 0.601618 0.668937 B\n0.000000 -0.000000 0.840963 B\n0.999999 0.000000 0.340962 B\n0.601619 0.224413 0.831063 B\n0.398381 0.775587 0.168937 B\n-0.000001 0.500000 0.411267 B\n0.000000 0.500000 0.588733 B\n0.601618 0.224414 0.168937 B\n0.499999 0.500000 0.250000 Ru\n0.893500 0.294025 0.744336 Ru\n0.294026 0.106500 0.755664 Ru\n0.294025 0.106501 0.244336 Ru\n0.212202 0.906730 -0.000000 Ru\n0.787798 0.093269 -0.000000 Ru\n0.893499 0.294026 0.255664 Ru\n0.093269 0.212202 0.500000 Ru\n0.705974 0.893500 0.244336 Ru\n0.906730 0.787798 0.500000 Ru\n0.705975 0.893499 0.755664 Ru\n0.106500 0.705975 0.255664 Ru\n0.106501 0.705974 0.744336 Ru\n0.500000 0.499999 0.750000 Ru\n",
"nsites": 34,
"nelements": 3,
"elements": [
"Sr",
"B",
"Ru"
],
"chemical_system": "B-Ru-Sr",
"density": 7.52994464101963,
"density_atomic": 0.07953717032713761,
"volume": 427.4730903822386,
"volume_molar": 7.571479768806009,
"formula_full": "Sr4 B16 Ru14",
"formula_reduced": "Sr2B8Ru7",
"formula_anonymous": "A2B7C8",
"energy_above_hull": 4.856182752156863,
"spacegroup": 84
},
{
"id": "jvasp-56219",
"created_at": "2022-09-04T14:37:31.069343Z",
"updated_at": "2022-09-04T14:37:31.069369Z",
"structure_string": "Li2 B12 C2\n1.0\n4.705272 0.000000 0.000000\n0.000000 4.778230 -2.307395\n0.000000 0.002127 5.306180\nLi B C\n2 12 2\ndirect\n0.500000 0.527744 0.115734 Li\n0.500000 0.115734 0.527744 Li\n0.817349 0.257618 0.257618 B\n0.693666 0.901523 0.097929 B\n0.693666 0.097928 0.901523 B\n0.183207 0.743118 0.743118 B\n0.000000 0.332613 0.993243 B\n0.306333 0.097928 0.901523 B\n0.000000 0.007513 0.668909 B\n0.000000 0.993243 0.332614 B\n0.306333 0.901523 0.097929 B\n0.182650 0.257618 0.257618 B\n0.000000 0.668909 0.007513 B\n0.816793 0.743118 0.743118 B\n0.646267 0.501638 0.501638 C\n0.353733 0.501638 0.501638 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"B",
"C"
],
"chemical_system": "B-C-Li",
"density": 2.332904768631107,
"density_atomic": 0.13409178158051888,
"volume": 119.32125751041936,
"volume_molar": 4.491058802424704,
"formula_full": "Li2 B12 C2",
"formula_reduced": "LiB6C",
"formula_anonymous": "ABC6",
"energy_above_hull": 4.8561644375,
"spacegroup": 38
},
{
"id": "jvasp-120390",
"created_at": "2022-09-04T14:38:53.878781Z",
"updated_at": "2022-09-04T14:38:53.878800Z",
"structure_string": "Au1 C2 N1\n1.0\n2.656977 -0.000000 0.000000\n0.000000 2.656977 0.000000\n-0.000000 -0.000000 5.160773\nAu C N\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Au\n0.000000 0.500000 -0.169045 C\n0.500000 0.000000 0.169045 C\n0.000000 0.000000 0.000000 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Au",
"C",
"N"
],
"chemical_system": "Au-C-N",
"density": 10.710673012824142,
"density_atomic": 0.10979173410925419,
"volume": 36.43261519140944,
"volume_molar": 5.48505842343955,
"formula_full": "Au1 C2 N1",
"formula_reduced": "AuC2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.855717705,
"spacegroup": 115
},
{
"id": "jvasp-14795",
"created_at": "2022-09-04T14:36:08.683320Z",
"updated_at": "2022-09-04T14:36:08.683346Z",
"structure_string": "Pu1 B2\n1.0\n1.586716 -2.748273 0.000000\n1.586716 2.748273 -0.000000\n0.000000 0.000000 4.017910\nPu B\n1 2\ndirect\n0.000000 0.000000 0.000000 Pu\n0.333335 0.666668 0.500000 B\n0.666668 0.333335 0.500000 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pu",
"B"
],
"chemical_system": "B-Pu",
"density": 12.587047394232194,
"density_atomic": 0.08561147554086561,
"volume": 35.04203123526339,
"volume_molar": 7.034268153835759,
"formula_full": "Pu1 B2",
"formula_reduced": "PuB2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.855405055555556,
"spacegroup": 191
},
{
"id": "jvasp-99987",
"created_at": "2022-09-04T14:36:53.710441Z",
"updated_at": "2022-09-04T14:36:53.710458Z",
"structure_string": "Hf1 Zr1 C1 N1\n1.0\n3.131083 -0.000992 4.730924\n1.423017 2.789034 4.730924\n-0.001621 -0.000992 5.673210\nHf Zr C N\n1 1 1 1\ndirect\n0.000944 0.000944 0.000944 Hf\n0.498917 0.498917 0.498916 Zr\n0.748196 0.748196 0.748194 C\n0.251943 0.251943 0.251943 N\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Hf",
"Zr",
"C",
"N"
],
"chemical_system": "C-Hf-N-Zr",
"density": 9.904701165307022,
"density_atomic": 0.0806779457627128,
"volume": 49.57984443189298,
"volume_molar": 7.464420050694044,
"formula_full": "Hf1 Zr1 C1 N1",
"formula_reduced": "HfZrCN",
"formula_anonymous": "ABCD",
"energy_above_hull": 4.8552976875,
"spacegroup": 160
},
{
"id": "jvasp-108063",
"created_at": "2022-09-04T14:35:51.429392Z",
"updated_at": "2022-09-04T14:35:51.429420Z",
"structure_string": "Ti1 Al2 Cr3 C2\n1.0\n2.898999 0.000000 0.000000\n-1.449499 2.510607 0.000000\n0.000000 0.000000 12.871456\nTi Al Cr C\n1 2 3 2\ndirect\n0.666667 0.333334 0.584230 Ti\n0.666667 0.333334 0.245744 Al\n0.333334 0.666667 0.763031 Al\n0.333334 0.666667 0.407979 Cr\n0.333334 0.666667 0.085281 Cr\n0.666667 0.333334 0.922118 Cr\n0.000000 0.000000 0.488045 C\n0.000000 0.000000 0.003574 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ti",
"Al",
"Cr",
"C"
],
"chemical_system": "Al-C-Cr-Ti",
"density": 4.995706402331811,
"density_atomic": 0.0853956030188688,
"volume": 93.68163836529546,
"volume_molar": 7.052050160790319,
"formula_full": "Ti1 Al2 Cr3 C2",
"formula_reduced": "TiAl2Cr3C2",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 4.854659516666667,
"spacegroup": 156
}
]
}