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_full&page=3825",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=3823",
"results": [
{
"id": "jvasp-65059",
"created_at": "2022-09-04T14:35:51.992633Z",
"updated_at": "2022-09-04T14:35:51.992658Z",
"structure_string": "Ta4 Be1 V1\n1.0\n0.000000 3.787265 3.787265\n3.787265 -0.000000 3.787265\n3.787265 3.787265 0.000000\nTa Be V\n4 1 1\ndirect\n0.127927 0.624024 0.624024 Ta\n0.624024 0.624024 0.127927 Ta\n0.624024 0.624024 0.624024 Ta\n0.624024 0.127927 0.624024 Ta\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 V\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"Be",
"V"
],
"chemical_system": "Be-Ta-V",
"density": 11.978899295596731,
"density_atomic": 0.055226074149193644,
"volume": 108.64433317839968,
"volume_molar": 10.904524452944353,
"formula_full": "Ta4 Be1 V1",
"formula_reduced": "Ta4BeV",
"formula_anonymous": "ABC4",
"energy_above_hull": 6.2369595166666665,
"spacegroup": 216
},
{
"id": "jvasp-16461",
"created_at": "2022-09-04T14:37:37.343175Z",
"updated_at": "2022-09-04T14:37:37.343200Z",
"structure_string": "Ta4 Be2\n1.0\n4.208554 0.000000 2.421320\n2.104277 4.279263 1.210661\n-0.029740 0.000000 4.919846\nTa Be\n4 2\ndirect\n0.160768 0.500000 0.178464 Ta\n0.339233 0.821535 0.500000 Ta\n0.660767 0.178464 0.500001 Ta\n0.839232 0.500000 0.821536 Ta\n0.250000 -0.000000 0.000000 Be\n0.749999 -0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Be"
],
"chemical_system": "Be-Ta",
"density": 13.854282882838673,
"density_atomic": 0.06748233097538706,
"volume": 88.91216283249597,
"volume_molar": 8.924025997555518,
"formula_full": "Ta4 Be2",
"formula_reduced": "Ta2Be",
"formula_anonymous": "AB2",
"energy_above_hull": 4.469574833333333,
"spacegroup": 140
},
{
"id": "jvasp-59110",
"created_at": "2022-09-04T14:37:30.216890Z",
"updated_at": "2022-09-04T14:37:30.216910Z",
"structure_string": "Ta4 Bi4 O16\n1.0\n5.014091 0.000000 0.000000\n-0.000000 5.710338 0.000000\n0.000000 0.000000 11.834443\nTa Bi O\n4 4 16\ndirect\n0.750000 0.862603 0.250000 Ta\n0.750000 0.637397 0.750000 Ta\n0.250000 0.137397 0.750000 Ta\n0.250000 0.362603 0.250000 Ta\n0.227589 0.750000 0.500000 Bi\n0.272410 0.750000 0.000000 Bi\n0.772410 0.250000 0.500000 Bi\n0.727589 0.250000 0.000000 Bi\n0.494281 0.641988 0.306024 O\n0.494281 0.858013 0.693976 O\n0.994281 0.358013 0.806023 O\n0.994281 0.141987 0.193976 O\n0.505719 0.358013 0.693976 O\n0.505719 0.141987 0.306024 O\n0.587205 0.583803 0.901722 O\n0.412795 0.416197 0.098278 O\n0.912795 0.583803 0.598278 O\n0.912795 0.916198 0.401722 O\n0.005719 0.858013 0.806023 O\n0.412795 0.083803 0.901722 O\n0.087205 0.416197 0.401722 O\n0.087205 0.083803 0.598278 O\n0.587205 0.916198 0.098278 O\n0.005719 0.641988 0.193976 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ta",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ta",
"density": 8.897995541879915,
"density_atomic": 0.07082871986092243,
"volume": 338.8455988916053,
"volume_molar": 8.502399551798947,
"formula_full": "Ta4 Bi4 O16",
"formula_reduced": "TaBiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.78748125,
"spacegroup": 52
},
{
"id": "jvasp-35395",
"created_at": "2022-09-04T14:37:56.363035Z",
"updated_at": "2022-09-04T14:37:56.363060Z",
"structure_string": "Ta4 C3\n1.0\n4.447647 -0.000000 0.000000\n0.000000 4.447647 -0.000000\n-0.000000 0.000000 4.447647\nTa C\n4 3\ndirect\n0.000000 0.500000 0.500000 Ta\n0.500000 0.000000 0.500000 Ta\n0.500000 0.500000 0.000000 Ta\n0.000000 0.000000 0.000000 Ta\n0.500000 0.000000 0.000000 C\n0.000000 0.500000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ta",
"C"
],
"chemical_system": "C-Ta",
"density": 14.340719942432282,
"density_atomic": 0.07956225931228325,
"volume": 87.9814130532025,
"volume_molar": 7.569092195286955,
"formula_full": "Ta4 C3",
"formula_reduced": "Ta4C3",
"formula_anonymous": "A3B4",
"energy_above_hull": 7.258275257142856,
"spacegroup": 221
},
{
"id": "jvasp-103048",
"created_at": "2022-09-04T14:38:40.482599Z",
"updated_at": "2022-09-04T14:38:40.482615Z",
"structure_string": "Ta4 C3\n1.0\n3.100188 0.001449 9.951710\n1.515413 2.704567 9.951710\n0.002471 0.001449 10.423419\nTa C\n4 3\ndirect\n0.626576 0.626578 0.626576 Ta\n0.375830 0.375831 0.375830 Ta\n0.790101 0.790104 0.790102 Ta\n0.205531 0.205532 0.205532 Ta\n0.497376 0.497377 0.497376 C\n0.004269 0.004269 0.004269 C\n0.915313 0.915316 0.915314 C\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ta",
"C"
],
"chemical_system": "C-Ta",
"density": 14.45519254862923,
"density_atomic": 0.08019735289300692,
"volume": 87.28467645732468,
"volume_molar": 7.50915154024382,
"formula_full": "Ta4 C3",
"formula_reduced": "Ta4C3",
"formula_anonymous": "A3B4",
"energy_above_hull": 7.24361097142857,
"spacegroup": 160
},
{
"id": "jvasp-104688",
"created_at": "2022-09-04T14:36:51.757364Z",
"updated_at": "2022-09-04T14:36:51.757381Z",
"structure_string": "Ta4 Co1 Ni1\n1.0\n4.856287 0.000039 -1.205244\n-2.970905 3.841516 -1.205244\n-0.000019 -0.000039 5.003612\nTa Co Ni\n4 1 1\ndirect\n0.409583 0.909582 0.819164 Ta\n0.090420 0.590419 0.180838 Ta\n0.590420 0.409581 0.500001 Ta\n0.909582 0.090419 0.500001 Ta\n0.500001 0.500001 0.000001 Co\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"Co",
"Ni"
],
"chemical_system": "Co-Ni-Ta",
"density": 14.968206365781882,
"density_atomic": 0.06427765988181788,
"volume": 93.34502859985433,
"volume_molar": 9.368948357909142,
"formula_full": "Ta4 Co1 Ni1",
"formula_reduced": "Ta4CoNi",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.722031683333334,
"spacegroup": 97
},
{
"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-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-60650",
"created_at": "2022-09-04T14:36:31.611884Z",
"updated_at": "2022-09-04T14:36:31.611907Z",
"structure_string": "Ta4 Co4 Te8\n1.0\n0.000000 7.793832 0.012713\n6.330801 0.000000 0.000000\n0.000000 -3.560993 -7.485282\nTa Co Te\n4 4 8\ndirect\n0.309658 0.978266 0.515434 Ta\n0.190343 0.478266 0.484566 Ta\n0.690343 0.021734 0.484566 Ta\n0.809658 0.521734 0.515434 Ta\n0.941087 0.850200 0.395437 Co\n0.058913 0.149800 0.604563 Co\n0.441087 0.649799 0.395437 Co\n0.558913 0.350200 0.604564 Co\n0.355584 0.254839 0.270059 Te\n0.855584 0.245161 0.270059 Te\n0.144417 0.754839 0.729941 Te\n0.644417 0.745161 0.729941 Te\n0.907681 0.250301 0.812777 Te\n0.592319 0.750301 0.187224 Te\n0.092319 0.749699 0.187224 Te\n0.407681 0.249699 0.812776 Te\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ta",
"Co",
"Te"
],
"chemical_system": "Co-Ta-Te",
"density": 8.91055360214662,
"density_atomic": 0.04335500649884138,
"volume": 369.04619078831377,
"volume_molar": 13.890300674181505,
"formula_full": "Ta4 Co4 Te8",
"formula_reduced": "TaCoTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8774589083333333,
"spacegroup": 14
},
{
"id": "jvasp-56504",
"created_at": "2022-09-04T14:37:37.586033Z",
"updated_at": "2022-09-04T14:37:37.586052Z",
"structure_string": "Ta4 Co8\n1.0\n2.375500 -4.114488 0.000000\n2.375500 4.114488 -0.000000\n-0.000000 -0.000000 7.739787\nTa Co\n4 8\ndirect\n0.333333 0.666667 0.065385 Ta\n0.666667 0.333333 0.934615 Ta\n0.333333 0.666667 0.434615 Ta\n0.666667 0.333333 0.565386 Ta\n0.831946 0.663892 0.250000 Co\n0.831946 0.168054 0.250000 Co\n0.168054 0.336108 0.750000 Co\n0.663892 0.831946 0.750000 Co\n0.336108 0.168054 0.250000 Co\n0.000000 0.000000 0.000000 Co\n0.168054 0.831946 0.750000 Co\n0.000000 0.000000 0.500000 Co\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ta",
"Co"
],
"chemical_system": "Co-Ta",
"density": 13.11839135564882,
"density_atomic": 0.07931428373462761,
"volume": 151.29683374750005,
"volume_molar": 7.592756911414695,
"formula_full": "Ta4 Co8",
"formula_reduced": "TaCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.852673666666666,
"spacegroup": 194
},
{
"id": "jvasp-42538",
"created_at": "2022-09-04T14:36:13.548199Z",
"updated_at": "2022-09-04T14:36:13.548219Z",
"structure_string": "Ta4 Cr2 N2 O10\n1.0\n4.720540 0.000000 0.000000\n0.000000 4.725413 0.000000\n0.000000 0.000000 9.204634\nTa Cr N O\n4 2 2 10\ndirect\n0.744099 0.013747 0.337611 Ta\n0.744099 0.013747 0.662388 Ta\n0.255901 0.513747 0.162389 Ta\n0.255901 0.513747 0.837611 Ta\n0.750084 0.993522 0.000000 Cr\n0.249916 0.493523 0.500000 Cr\n0.452156 0.695548 0.000000 N\n0.547844 0.195548 0.500000 N\n0.445668 0.691600 0.667607 O\n0.445668 0.691600 0.332392 O\n0.055859 0.300052 0.000000 O\n0.053497 0.300092 0.666740 O\n0.944141 0.800051 0.500000 O\n0.946503 0.800091 0.166741 O\n0.946503 0.800091 0.833259 O\n0.554332 0.191600 0.167608 O\n0.053497 0.300092 0.333259 O\n0.554332 0.191600 0.832392 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ta",
"Cr",
"N",
"O"
],
"chemical_system": "Cr-N-O-Ta",
"density": 8.2151506338198,
"density_atomic": 0.08766667333872048,
"volume": 205.3231782898027,
"volume_molar": 6.8693615608431555,
"formula_full": "Ta4 Cr2 N2 O10",
"formula_reduced": "Ta2CrNO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 4.384984061111111,
"spacegroup": 31
},
{
"id": "jvasp-42453",
"created_at": "2022-09-04T14:36:39.004623Z",
"updated_at": "2022-09-04T14:36:39.004644Z",
"structure_string": "Ta4 Cr2 N2 O10\n1.0\n4.716664 0.018935 0.000000\n0.018935 4.716664 0.000000\n0.000000 0.000000 9.231609\nTa Cr N O\n4 2 2 10\ndirect\n0.000000 0.000000 0.342962 Ta\n0.000000 0.000000 0.657038 Ta\n0.500000 0.500000 0.168132 Ta\n0.500000 0.500000 0.831869 Ta\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.198741 0.801259 0.500000 N\n0.801259 0.198741 0.500000 N\n0.694691 0.694691 0.671643 O\n0.694691 0.694691 0.328357 O\n0.696529 0.696529 0.000000 O\n0.303471 0.303471 0.000000 O\n0.198180 0.801821 0.837710 O\n0.305309 0.305309 0.328357 O\n0.198180 0.801821 0.162291 O\n0.801821 0.198180 0.162291 O\n0.305309 0.305309 0.671643 O\n0.801821 0.198180 0.837710 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ta",
"Cr",
"N",
"O"
],
"chemical_system": "Cr-N-O-Ta",
"density": 8.213215678158372,
"density_atomic": 0.08764602476714141,
"volume": 205.3715504818676,
"volume_molar": 6.870979917229181,
"formula_full": "Ta4 Cr2 N2 O10",
"formula_reduced": "Ta2CrNO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 4.385406283333333,
"spacegroup": 65
}
]
}