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=4210",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4208",
"results": [
{
"id": "jvasp-108729",
"created_at": "2022-09-04T14:38:00.160287Z",
"updated_at": "2022-09-04T14:38:00.160314Z",
"structure_string": "Ti2 Al2 V2 C2\n1.0\n2.993390 -0.000000 0.000000\n-1.496695 2.592352 0.000000\n0.000000 -0.000000 13.369590\nTi Al V C\n2 2 2 2\ndirect\n0.666667 0.333333 0.412063 Ti\n0.333334 0.666666 0.587937 Ti\n0.666667 0.333333 0.758616 Al\n0.333334 0.666666 0.241384 Al\n0.333334 0.666666 0.918563 V\n0.666667 0.333333 0.081437 V\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ti",
"Al",
"V",
"C"
],
"chemical_system": "Al-C-Ti-V",
"density": 4.411185024927571,
"density_atomic": 0.07711069597328896,
"volume": 103.74695622992677,
"volume_molar": 7.809734672977224,
"formula_full": "Ti2 Al2 V2 C2",
"formula_reduced": "TiAlVC",
"formula_anonymous": "ABCD",
"energy_above_hull": 3.8115113333333337,
"spacegroup": 164
},
{
"id": "jvasp-111123",
"created_at": "2022-09-04T14:38:37.270947Z",
"updated_at": "2022-09-04T14:38:37.270967Z",
"structure_string": "Cr2 Pb2 N4\n1.0\n3.578412 0.000000 0.000000\n0.000000 3.578412 0.000000\n-0.000000 -0.000000 9.494920\nCr Pb N\n2 2 4\ndirect\n0.749999 0.749999 0.579209 Cr\n0.250000 0.250000 0.420791 Cr\n0.749999 0.749999 0.149214 Pb\n0.250000 0.250000 0.850786 Pb\n0.749999 0.250000 0.500000 N\n0.250000 0.749999 0.500000 N\n0.749999 0.749999 0.758796 N\n0.250000 0.250000 0.241204 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Pb",
"N"
],
"chemical_system": "Cr-N-Pb",
"density": 7.845233985734797,
"density_atomic": 0.06579880313646684,
"volume": 121.58275863176395,
"volume_molar": 9.152356080869843,
"formula_full": "Cr2 Pb2 N4",
"formula_reduced": "CrPbN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.81233868,
"spacegroup": 129
},
{
"id": "jvasp-111083",
"created_at": "2022-09-04T14:38:37.257434Z",
"updated_at": "2022-09-04T14:38:37.257450Z",
"structure_string": "Cr2 Mo2 As4\n1.0\n3.338172 -0.000000 0.000000\n0.000000 5.903747 0.000000\n-0.000000 0.000000 6.284675\nCr Mo As\n2 2 4\ndirect\n-0.000000 0.512638 0.433029 Cr\n-0.000000 0.012638 0.566972 Cr\n0.500000 0.491271 0.063395 Mo\n0.500000 0.991271 0.936605 Mo\n0.500000 0.305848 0.664556 As\n0.500000 0.805848 0.335444 As\n-0.000000 0.690245 0.806233 As\n-0.000000 0.190245 0.193768 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Mo",
"As"
],
"chemical_system": "As-Cr-Mo",
"density": 7.984621355675307,
"density_atomic": 0.06459080766970128,
"volume": 123.85663360813953,
"volume_molar": 9.323526020599536,
"formula_full": "Cr2 Mo2 As4",
"formula_reduced": "CrMoAs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8126917,
"spacegroup": 26
},
{
"id": "jvasp-64905",
"created_at": "2022-09-04T14:36:05.290253Z",
"updated_at": "2022-09-04T14:36:05.290278Z",
"structure_string": "Be1 Co4 Tc1\n1.0\n-0.000000 3.221973 3.221973\n3.221973 0.000000 3.221973\n3.221973 3.221973 0.000000\nBe Co Tc\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.122410 0.625863 0.625863 Co\n0.625863 0.625863 0.625863 Co\n0.625863 0.122410 0.625863 Co\n0.625863 0.625863 0.122410 Co\n0.250000 0.250000 0.250000 Tc\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Co",
"Tc"
],
"chemical_system": "Be-Co-Tc",
"density": 8.507941429003175,
"density_atomic": 0.0896923833663797,
"volume": 66.895312342085,
"volume_molar": 6.7142164518033525,
"formula_full": "Be1 Co4 Tc1",
"formula_reduced": "BeCo4Tc",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.8128368666666654,
"spacegroup": 216
},
{
"id": "jvasp-96812",
"created_at": "2022-09-04T14:36:13.462854Z",
"updated_at": "2022-09-04T14:36:13.462881Z",
"structure_string": "Si2 H16 C4 N2 Cl2 O2\n1.0\n5.465383 0.041546 -1.201994\n-0.784684 6.181577 -1.226413\n-0.032327 0.025497 8.628556\nSi H C N Cl O\n2 16 4 2 2 2\ndirect\n0.941045 0.296699 0.677645 Si\n0.058955 0.703302 0.322357 Si\n0.183473 0.848419 0.480203 H\n0.777419 0.434051 0.986088 H\n0.538102 0.091743 0.254275 H\n0.715013 0.842650 0.657943 H\n0.284987 0.157352 0.342058 H\n0.792495 0.192534 0.068110 H\n0.222581 0.565950 0.013913 H\n0.152344 0.494332 0.275189 H\n0.207505 0.807468 0.931891 H\n0.265226 0.164310 0.131485 H\n0.506674 0.246989 0.947467 H\n0.816527 0.151582 0.519799 H\n0.734774 0.835691 0.868516 H\n0.847656 0.505670 0.724813 H\n0.461898 0.908259 0.745727 H\n0.493326 0.753012 0.052534 H\n0.291812 0.737810 0.035735 C\n0.708188 0.262192 0.964267 C\n0.335715 0.081396 0.230456 C\n0.664285 0.918605 0.769545 C\n0.239560 0.852982 0.185695 N\n0.760440 0.147019 0.814306 N\n0.288797 0.404912 0.636207 Cl\n0.711203 0.595090 0.363794 Cl\n0.036295 0.168885 0.832508 O\n0.963705 0.831116 0.167494 O\n",
"nsites": 28,
"nelements": 6,
"elements": [
"Si",
"H",
"C",
"N",
"Cl",
"O"
],
"chemical_system": "C-Cl-H-N-O-Si",
"density": 1.4300749956213086,
"density_atomic": 0.09597233272522009,
"volume": 291.7507494599224,
"volume_molar": 6.274871714582667,
"formula_full": "Si2 H16 C4 N2 Cl2 O2",
"formula_reduced": "SiH8C2NClO",
"formula_anonymous": "ABCDE2F8",
"energy_above_hull": 3.814080672678572,
"spacegroup": 2
},
{
"id": "jvasp-15850",
"created_at": "2022-09-04T14:38:18.841661Z",
"updated_at": "2022-09-04T14:38:18.841683Z",
"structure_string": "Ru1 C1\n1.0\n1.465048 -2.537536 -0.000000\n1.465048 2.537536 0.000000\n0.000000 0.000000 2.686350\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.666668 0.333334 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ru",
"C"
],
"chemical_system": "C-Ru",
"density": 9.40114883527141,
"density_atomic": 0.10013210319936018,
"volume": 19.973614216592022,
"volume_molar": 6.014195814912714,
"formula_full": "Ru1 C1",
"formula_reduced": "RuC",
"formula_anonymous": "AB",
"energy_above_hull": 3.81427025,
"spacegroup": 187
},
{
"id": "jvasp-14265",
"created_at": "2022-09-04T14:36:59.060454Z",
"updated_at": "2022-09-04T14:36:59.060480Z",
"structure_string": "Ru1 C1\n1.0\n1.465048 -2.537536 -0.000000\n1.465048 2.537536 -0.000000\n-0.000000 0.000000 2.686350\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.666668 0.333334 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ru",
"C"
],
"chemical_system": "C-Ru",
"density": 9.40114883527141,
"density_atomic": 0.10013210319936018,
"volume": 19.973614216592022,
"volume_molar": 6.014195814912714,
"formula_full": "Ru1 C1",
"formula_reduced": "RuC",
"formula_anonymous": "AB",
"energy_above_hull": 3.81427025,
"spacegroup": 187
},
{
"id": "jvasp-89125",
"created_at": "2022-09-04T14:36:20.689950Z",
"updated_at": "2022-09-04T14:36:20.689976Z",
"structure_string": "V4 W2 O12\n1.0\n4.664805 -0.000000 0.000000\n0.000000 4.664805 0.000000\n0.000000 0.000000 8.820962\nV W O\n4 2 12\ndirect\n0.000000 0.000000 0.333434 V\n0.499998 0.499998 0.833433 V\n0.499998 0.499998 0.166567 V\n0.000000 0.000000 0.666566 V\n0.000000 0.000000 0.000000 W\n0.499998 0.499998 0.499999 W\n0.702532 0.702532 0.000000 O\n0.298933 0.298933 0.337135 O\n0.201066 0.798933 0.837136 O\n0.701064 0.701064 0.662864 O\n0.297467 0.297467 0.000000 O\n0.798933 0.201066 0.837136 O\n0.798933 0.201066 0.162864 O\n0.201066 0.798933 0.162864 O\n0.701064 0.701064 0.337135 O\n0.298933 0.298933 0.662864 O\n0.202534 0.797465 0.499999 O\n0.797465 0.202534 0.499999 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"W",
"O"
],
"chemical_system": "O-V-W",
"density": 6.604506723584005,
"density_atomic": 0.09377553836189798,
"volume": 191.9477116786524,
"volume_molar": 6.4218674349374485,
"formula_full": "V4 W2 O12",
"formula_reduced": "V2WO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.814491044444445,
"spacegroup": 136
},
{
"id": "jvasp-113131",
"created_at": "2022-09-04T14:38:42.343476Z",
"updated_at": "2022-09-04T14:38:42.343504Z",
"structure_string": "Mg4 Os4 N8\n1.0\n5.428304 -0.000000 0.000000\n0.000000 6.692138 0.000000\n-0.000000 0.000000 5.512621\nMg Os N\n4 4 8\ndirect\n0.597201 0.877571 0.999494 Mg\n0.402798 0.122430 0.499494 Mg\n0.902798 0.377570 0.499494 Mg\n0.097202 0.622430 0.999494 Mg\n0.556185 0.342268 0.025330 Os\n0.443814 0.657732 0.525330 Os\n0.943814 0.842268 0.525330 Os\n0.056185 0.157732 0.025330 Os\n0.547357 0.397347 0.366696 N\n0.452642 0.602653 0.866696 N\n0.952642 0.897347 0.866696 N\n0.047357 0.102653 0.366696 N\n0.611158 0.883456 0.378480 N\n0.388841 0.116544 0.878480 N\n0.888841 0.383456 0.878480 N\n0.111158 0.616544 0.378480 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Os",
"N"
],
"chemical_system": "Mg-N-Os",
"density": 8.044893853682652,
"density_atomic": 0.0798974278170925,
"volume": 200.25675966225677,
"volume_molar": 7.5373399676725015,
"formula_full": "Mg4 Os4 N8",
"formula_reduced": "MgOsN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8145376375,
"spacegroup": 33
},
{
"id": "jvasp-79276",
"created_at": "2022-09-04T14:37:14.102224Z",
"updated_at": "2022-09-04T14:37:14.102233Z",
"structure_string": "B2 N2\n1.0\n2.487326 -0.000000 -0.000000\n-1.243662 2.154087 0.000000\n0.000000 0.000000 4.455116\nB N\n2 2\ndirect\n0.666669 0.333333 0.749999 B\n0.333335 0.666668 0.250002 B\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 3.4529131737131005,
"density_atomic": 0.16757337844638753,
"volume": 23.870139977393467,
"volume_molar": 3.593733572619167,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 3.8149229166666663,
"spacegroup": 194
},
{
"id": "jvasp-88440",
"created_at": "2022-09-04T14:35:46.181228Z",
"updated_at": "2022-09-04T14:35:46.181256Z",
"structure_string": "Ta4 Co2 O12\n1.0\n4.780936 -0.000000 0.000000\n-0.000000 4.780936 0.000000\n0.000000 0.000000 9.135976\nTa Co O\n4 2 12\ndirect\n0.000000 0.000000 0.669709 Ta\n0.499999 0.499999 0.830292 Ta\n0.000000 0.000000 0.330291 Ta\n0.499999 0.499999 0.169709 Ta\n0.499999 0.499999 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.691605 0.691605 0.000000 O\n0.295486 0.295486 0.325758 O\n0.204514 0.795487 0.825758 O\n0.704515 0.704515 0.674242 O\n0.308396 0.308396 0.000000 O\n0.795487 0.204514 0.825758 O\n0.795487 0.204514 0.174242 O\n0.204514 0.795487 0.174242 O\n0.704515 0.704515 0.325758 O\n0.295486 0.295486 0.674242 O\n0.191604 0.808397 0.500000 O\n0.808397 0.191604 0.500000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ta",
"Co",
"O"
],
"chemical_system": "Co-O-Ta",
"density": 8.21943744615065,
"density_atomic": 0.08619690950970434,
"volume": 208.82419221739613,
"volume_molar": 6.986492664591422,
"formula_full": "Ta4 Co2 O12",
"formula_reduced": "Ta2CoO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.815121144444445,
"spacegroup": 136
},
{
"id": "jvasp-80680",
"created_at": "2022-09-04T14:37:15.105830Z",
"updated_at": "2022-09-04T14:37:15.105850Z",
"structure_string": "Li1 Nb1 Ru2\n1.0\n-9.719374 1.889179 -2.584858\n-6.510896 -0.125741 0.652456\n-5.196076 3.672004 -1.631907\nLi Nb Ru\n1 1 2\ndirect\n-0.000000 0.000010 -0.000009 Li\n0.500001 0.000003 -0.000004 Nb\n0.736507 0.008813 0.010277 Ru\n0.263494 -0.008827 -0.010263 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Nb",
"Ru"
],
"chemical_system": "Li-Nb-Ru",
"density": 8.60116288935358,
"density_atomic": 0.06860871290353344,
"volume": 58.30163299556658,
"volume_molar": 8.777516010929059,
"formula_full": "Li1 Nb1 Ru2",
"formula_reduced": "LiNbRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8155726,
"spacegroup": 71
}
]
}