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=chemical_system&page=1547",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=1545",
"results": [
{
"id": "jvasp-88371",
"created_at": "2022-09-04T14:37:51.774103Z",
"updated_at": "2022-09-04T14:37:51.774127Z",
"structure_string": "Y4 B16 Mo4\n1.0\n3.642308 0.000000 0.000000\n0.000000 6.026775 0.000000\n0.000000 0.000000 11.643655\nY B Mo\n4 16 4\ndirect\n0.000000 0.373201 0.649787 Y\n0.000000 0.626800 0.350213 Y\n0.000000 0.873202 0.850213 Y\n0.000000 0.126799 0.149787 Y\n0.500000 0.024241 0.693465 B\n0.500000 0.133543 0.968296 B\n0.500000 0.866458 0.031704 B\n0.500000 0.633544 0.531704 B\n0.500000 0.366457 0.468296 B\n0.500000 0.786657 0.186122 B\n0.500000 0.213344 0.813878 B\n0.500000 0.286656 0.313878 B\n0.500000 0.385967 0.047489 B\n0.500000 0.614034 0.952511 B\n0.500000 0.885968 0.452511 B\n0.500000 0.114033 0.547489 B\n0.500000 0.475759 0.193465 B\n0.500000 0.524241 0.806535 B\n0.500000 0.975760 0.306535 B\n0.500000 0.713345 0.686122 B\n0.000000 0.629277 0.083443 Mo\n0.000000 0.129276 0.416557 Mo\n0.000000 0.870725 0.583443 Mo\n0.000000 0.370724 0.916557 Mo\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Y",
"B",
"Mo"
],
"chemical_system": "B-Mo-Y",
"density": 5.927397787702726,
"density_atomic": 0.09389884862582194,
"volume": 255.59418833384993,
"volume_molar": 6.413434081601642,
"formula_full": "Y4 B16 Mo4",
"formula_reduced": "YB4Mo",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.847955280555556,
"spacegroup": 55
},
{
"id": "jvasp-97386",
"created_at": "2022-09-04T14:37:51.793472Z",
"updated_at": "2022-09-04T14:37:51.793495Z",
"structure_string": "Y4 B28 Mo12\n1.0\n3.102607 0.000000 0.000000\n0.000000 11.030774 0.000019\n0.000000 0.000022 12.932641\nY B Mo\n4 28 12\ndirect\n0.750001 0.949845 0.308238 Y\n0.250000 0.050155 0.691762 Y\n0.750001 0.449845 0.191762 Y\n0.250000 0.550154 0.808238 Y\n0.250000 0.314554 0.067053 B\n0.750001 0.185446 0.567053 B\n0.250000 0.814554 0.432947 B\n0.750001 0.568032 0.384178 B\n0.250000 0.431967 0.615822 B\n0.750001 0.068033 0.115822 B\n0.250000 0.931967 0.884178 B\n0.750001 0.537435 0.981735 B\n0.750001 0.037435 0.518265 B\n0.750001 0.685445 0.932947 B\n0.250000 0.962564 0.481735 B\n0.750001 0.750688 0.173455 B\n0.250000 0.249311 0.826545 B\n0.750001 0.250688 0.326544 B\n0.250000 0.749311 0.673456 B\n0.750001 0.731001 0.418272 B\n0.250000 0.268998 0.581728 B\n0.250000 0.462564 0.018265 B\n0.250000 0.834945 0.167244 B\n0.250000 0.334945 0.332756 B\n0.750001 0.231002 0.081728 B\n0.750001 0.165054 0.832756 B\n0.750001 0.510038 0.637711 B\n0.250000 0.489961 0.362289 B\n0.250000 0.768998 0.918272 B\n0.250000 0.989961 0.137710 B\n0.750001 0.665055 0.667244 B\n0.750001 0.010039 0.862290 B\n0.250000 0.617636 0.526826 Mo\n0.750001 0.382363 0.473174 Mo\n0.250000 0.117637 0.973174 Mo\n0.250000 0.660244 0.064607 Mo\n0.750001 0.339756 0.935393 Mo\n0.250000 0.160244 0.435393 Mo\n0.750001 0.839756 0.564607 Mo\n0.250000 0.685128 0.297651 Mo\n0.750001 0.314871 0.702349 Mo\n0.250000 0.185128 0.202349 Mo\n0.750001 0.814871 0.797651 Mo\n0.750001 0.882363 0.026826 Mo\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Y",
"B",
"Mo"
],
"chemical_system": "B-Mo-Y",
"density": 6.789134992791926,
"density_atomic": 0.09941060105456885,
"volume": 442.6087311940439,
"volume_molar": 6.057845638308034,
"formula_full": "Y4 B28 Mo12",
"formula_reduced": "YB7Mo3",
"formula_anonymous": "AB3C7",
"energy_above_hull": 5.694214657575758,
"spacegroup": 62
},
{
"id": "jvasp-99894",
"created_at": "2022-09-04T14:36:11.796867Z",
"updated_at": "2022-09-04T14:36:11.796892Z",
"structure_string": "Zr1 B4 Mo1\n1.0\n3.124325 0.000000 0.000000\n-1.562163 2.705745 0.000000\n0.000000 0.000000 6.785928\nZr B Mo\n1 4 1\ndirect\n0.000000 0.000000 0.500000 Zr\n0.666669 0.333334 0.760178 B\n0.666669 0.333334 0.239822 B\n0.333335 0.666668 0.760178 B\n0.333335 0.666668 0.239822 B\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"B",
"Mo"
],
"chemical_system": "B-Mo-Zr",
"density": 6.669516260607115,
"density_atomic": 0.10459211243454648,
"volume": 57.365702444864446,
"volume_molar": 5.757738915320831,
"formula_full": "Zr1 B4 Mo1",
"formula_reduced": "ZrB4Mo",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.112853455555556,
"spacegroup": 191
},
{
"id": "jvasp-63377",
"created_at": "2022-09-04T14:36:18.264750Z",
"updated_at": "2022-09-04T14:36:18.264775Z",
"structure_string": "B4 N4\n1.0\n2.514390 3.275901 0.963900\n-2.514390 3.275901 0.963900\n0.000000 2.283948 4.336399\nB N\n4 4\ndirect\n0.026022 0.276021 0.447962 B\n0.723979 0.973977 0.052038 B\n0.973977 0.723979 0.552038 B\n0.276021 0.026023 0.947962 B\n0.053399 0.303346 0.749950 N\n0.696654 0.946601 0.750051 N\n0.946601 0.696654 0.250051 N\n0.303346 0.053399 0.249949 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.7307238714576854,
"density_atomic": 0.13252479912557003,
"volume": 60.36606018485515,
"volume_molar": 4.544161394497867,
"formula_full": "B4 N4",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.7689079166666666,
"spacegroup": 70
},
{
"id": "jvasp-22673",
"created_at": "2022-09-04T14:36:10.155042Z",
"updated_at": "2022-09-04T14:36:10.155090Z",
"structure_string": "B2 N2\n1.0\n2.511976 0.000000 -0.000000\n-1.255989 2.175436 0.000000\n0.000000 -0.000000 6.558615\nB N\n2 2\ndirect\n0.000000 0.000000 0.000000 B\n0.333334 0.666668 0.500000 B\n0.333334 0.666668 0.000000 N\n0.666668 0.333334 0.500000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.299676190186781,
"density_atomic": 0.11160561796227074,
"volume": 35.840489690691335,
"volume_molar": 5.395911845616802,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.513047916666667,
"spacegroup": 187
},
{
"id": "jvasp-4843",
"created_at": "2022-09-04T14:36:21.170041Z",
"updated_at": "2022-09-04T14:36:21.170077Z",
"structure_string": "B1 N1\n1.0\n2.451717 0.086100 2.613323\n1.090731 2.197415 2.613323\n0.133569 0.086100 3.580856\nB N\n1 1\ndirect\n0.999718 0.999719 0.999715 B\n0.332716 0.332717 0.332715 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.3007147153661514,
"density_atomic": 0.11165601864255242,
"volume": 17.912155782686973,
"volume_molar": 5.393476171919447,
"formula_full": "B1 N1",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.513012916666667,
"spacegroup": 160
},
{
"id": "jvasp-79204",
"created_at": "2022-09-04T14:37:11.766527Z",
"updated_at": "2022-09-04T14:37:11.766542Z",
"structure_string": "B2 N2\n1.0\n-1.277109 -2.212017 0.000000\n-1.277109 2.212017 0.000000\n0.000000 0.000000 -4.225650\nB N\n2 2\ndirect\n0.333334 0.666667 0.499769 B\n0.666667 0.333334 0.999769 B\n0.333333 0.666668 0.125231 N\n0.666668 0.333333 0.625231 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 3.452237608649316,
"density_atomic": 0.16754059258864845,
"volume": 23.87481110217236,
"volume_molar": 3.5944368268923177,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.5462079166666665,
"spacegroup": 186
},
{
"id": "jvasp-62940",
"created_at": "2022-09-04T14:35:48.661628Z",
"updated_at": "2022-09-04T14:35:48.661659Z",
"structure_string": "B2 N2\n1.0\n1.256156 -2.175740 0.000000\n1.256156 2.175740 -0.000000\n0.000000 -0.000000 6.576173\nB N\n2 2\ndirect\n0.333344 0.666659 0.250000 B\n0.666659 0.333344 0.750000 B\n0.333327 0.666676 0.750000 N\n0.666676 0.333327 0.250000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.292909031756356,
"density_atomic": 0.11127720090003433,
"volume": 35.94626722857086,
"volume_molar": 5.4118370261757205,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.5130329166666665,
"spacegroup": 194
},
{
"id": "jvasp-93373",
"created_at": "2022-09-04T14:35:54.202512Z",
"updated_at": "2022-09-04T14:35:54.202529Z",
"structure_string": "B3 N3\n1.0\n0.000000 2.660930 0.000000\n0.000000 0.000000 4.241389\n3.503601 -1.330465 -2.120694\nB N\n3 3\ndirect\n-0.000000 0.949399 -0.000000 B\n0.192430 0.616768 0.384862 B\n0.807568 0.231906 0.615138 B\n0.808839 0.601343 0.617682 N\n0.191159 0.983661 0.382318 N\n-0.000000 0.276925 -0.000000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 3.126624202918046,
"density_atomic": 0.15173824375427347,
"volume": 39.5417783384686,
"volume_molar": 3.968769250916281,
"formula_full": "B3 N3",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.6494279166666668,
"spacegroup": 44
},
{
"id": "jvasp-63657",
"created_at": "2022-09-04T14:35:54.636080Z",
"updated_at": "2022-09-04T14:35:54.636096Z",
"structure_string": "B4 N4\n1.0\n3.205457 0.007868 0.001653\n1.169060 4.189602 -0.001573\n1.600156 0.006467 4.732735\nB N\n4 4\ndirect\n0.566996 0.999842 0.868535 B\n0.435518 0.499841 0.131464 B\n0.565445 0.508118 0.613500 B\n0.178931 0.008115 0.386497 B\n0.778633 0.159606 0.608950 N\n0.387557 0.659601 0.391053 N\n0.511581 0.678640 0.868593 N\n0.380149 0.178641 0.131403 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.595785920714043,
"density_atomic": 0.12597612351481655,
"volume": 63.50409725902614,
"volume_molar": 4.78038265663232,
"formula_full": "B4 N4",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.6069429166666667,
"spacegroup": 9
},
{
"id": "jvasp-7821",
"created_at": "2022-09-04T14:36:43.161210Z",
"updated_at": "2022-09-04T14:36:43.161226Z",
"structure_string": "B4 N4\n1.0\n2.467167 0.000000 -0.473363\n-0.015641 4.376891 -0.081519\n-0.001456 -0.044059 6.658530\nB N\n4 4\ndirect\n-0.000035 0.001524 -0.000071 B\n0.799917 0.570348 0.599834 B\n0.134414 0.622199 0.268827 B\n0.468353 0.500813 0.936706 B\n0.019445 0.657973 0.038890 N\n0.493658 0.156821 0.987317 N\n0.352964 0.552629 0.705930 N\n0.687785 0.609191 0.375569 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.292987562572582,
"density_atomic": 0.11128101208019586,
"volume": 71.89007226349374,
"volume_molar": 5.4116516802166394,
"formula_full": "B4 N4",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.5820729166666667,
"spacegroup": 8
},
{
"id": "jvasp-29590",
"created_at": "2022-09-04T14:36:41.254610Z",
"updated_at": "2022-09-04T14:36:41.254641Z",
"structure_string": "B4 N4\n1.0\n3.550709 -0.202991 0.000000\n-1.261175 4.580542 0.000000\n0.000000 0.000000 4.935103\nB N\n4 4\ndirect\n0.858311 0.358394 0.357292 B\n0.141690 0.641606 0.642707 B\n0.641690 0.141606 0.857292 B\n0.358312 0.858394 0.142707 B\n0.158101 0.657016 0.343771 N\n0.658100 0.157016 0.156229 N\n0.841901 0.342984 0.656228 N\n0.341901 0.842984 0.843771 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 2.086569518573892,
"density_atomic": 0.101263335044906,
"volume": 79.00194079577113,
"volume_molar": 5.947010097316502,
"formula_full": "B4 N4",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.6840629166666665,
"spacegroup": 14
}
]
}