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=-id&page=616",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=614",
"results": [
{
"id": "jvasp-8357",
"created_at": "2022-09-04T14:37:07.342954Z",
"updated_at": "2022-09-04T14:37:07.342980Z",
"structure_string": "Al1 W1 F5\n1.0\n3.472020 0.000000 1.276803\n1.441525 5.052508 1.439196\n-0.032427 -0.052527 5.447321\nAl W F\n1 1 5\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 W\n0.500001 0.777478 0.222522 F\n0.500000 0.222521 0.777478 F\n0.731989 0.268011 0.268011 F\n0.268012 0.731988 0.731989 F\n0.000000 0.500000 0.500000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"W",
"F"
],
"chemical_system": "Al-F-W",
"density": 5.293376115973521,
"density_atomic": 0.07296674368508047,
"volume": 95.9341152760157,
"volume_molar": 8.253267798260469,
"formula_full": "Al1 W1 F5",
"formula_reduced": "AlWF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 1.112050601785714,
"spacegroup": 71
},
{
"id": "jvasp-8356",
"created_at": "2022-09-04T14:37:06.580791Z",
"updated_at": "2022-09-04T14:37:06.580809Z",
"structure_string": "Mg1 W1 F6\n1.0\n4.607925 0.090292 3.066943\n1.689464 4.287986 3.066943\n0.129870 0.090292 5.533736\nMg W F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 W\n0.376299 0.123140 0.751438 F\n0.123140 0.751438 0.376298 F\n0.248562 0.623702 0.876859 F\n0.876860 0.248562 0.623701 F\n0.623701 0.876859 0.248562 F\n0.751438 0.376298 0.123140 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"W",
"F"
],
"chemical_system": "F-Mg-W",
"density": 5.045674783074376,
"density_atomic": 0.07546084527759878,
"volume": 106.0152449998446,
"volume_molar": 7.98048410118688,
"formula_full": "Mg1 W1 F6",
"formula_reduced": "MgWF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.5454263431250002,
"spacegroup": 148
},
{
"id": "jvasp-8355",
"created_at": "2022-09-04T14:37:06.514169Z",
"updated_at": "2022-09-04T14:37:06.514188Z",
"structure_string": "Mg1 Mn1 F6\n1.0\n4.409750 0.056331 2.883859\n1.588610 4.114048 2.883859\n0.081023 0.056331 5.268393\nMg Mn F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mn\n0.365014 0.109406 0.764411 F\n0.109406 0.764412 0.365014 F\n0.235588 0.634987 0.890594 F\n0.890593 0.235588 0.634987 F\n0.634986 0.890594 0.235589 F\n0.764411 0.365014 0.109407 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"F"
],
"chemical_system": "F-Mg-Mn",
"density": 3.4244249305760937,
"density_atomic": 0.08537804379375864,
"volume": 93.7009053442944,
"volume_molar": 7.053500516534714,
"formula_full": "Mg1 Mn1 F6",
"formula_reduced": "MgMnF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.00201375,
"spacegroup": 148
},
{
"id": "jvasp-8354",
"created_at": "2022-09-04T14:37:17.234393Z",
"updated_at": "2022-09-04T14:37:17.234404Z",
"structure_string": "Mg1 Ni1 F6\n1.0\n4.336321 0.075538 2.870117\n1.581040 4.038526 2.870118\n0.108649 0.075537 5.198985\nMg Ni F\n1 1 6\ndirect\n0.500000 0.500001 0.500000 Mg\n0.000000 0.000000 0.000000 Ni\n0.378909 0.089670 0.769876 F\n0.089669 0.769878 0.378909 F\n0.230123 0.621092 0.910329 F\n0.910330 0.230125 0.621090 F\n0.621090 0.910332 0.230124 F\n0.769876 0.378910 0.089670 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ni",
"F"
],
"chemical_system": "F-Mg-Ni",
"density": 3.692277801627945,
"density_atomic": 0.09030123331633608,
"volume": 88.59236697216569,
"volume_molar": 6.66894630209946,
"formula_full": "Mg1 Ni1 F6",
"formula_reduced": "MgNiF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-8353",
"created_at": "2022-09-04T14:37:05.486123Z",
"updated_at": "2022-09-04T14:37:05.486145Z",
"structure_string": "Mg1 Co1 F6\n1.0\n4.351528 0.066391 2.864168\n1.577764 4.055965 2.864168\n0.095494 0.066392 5.208659\nMg Co F\n1 1 6\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Co\n0.374258 0.095839 0.767880 F\n0.095838 0.767880 0.374259 F\n0.232120 0.625742 0.904162 F\n0.904160 0.232121 0.625743 F\n0.625741 0.904161 0.232122 F\n0.767879 0.374258 0.095840 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Co",
"F"
],
"chemical_system": "Co-F-Mg",
"density": 3.648409600029958,
"density_atomic": 0.0891198724210617,
"volume": 89.76673532702858,
"volume_molar": 6.757348946312884,
"formula_full": "Mg1 Co1 F6",
"formula_reduced": "MgCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0039387853124999,
"spacegroup": 148
},
{
"id": "jvasp-8352",
"created_at": "2022-09-04T14:37:17.153898Z",
"updated_at": "2022-09-04T14:37:17.153909Z",
"structure_string": "Mn1 Zn1 F6\n1.0\n4.424387 0.079196 2.932022\n1.615142 4.119805 2.932022\n0.113910 0.079196 5.306503\nMn Zn F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.499999 Zn\n0.374341 0.094445 0.767810 F\n0.094444 0.767810 0.374341 F\n0.232189 0.625659 0.905555 F\n0.905556 0.232190 0.625657 F\n0.625659 0.905556 0.232189 F\n0.767811 0.374341 0.094443 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"F"
],
"chemical_system": "F-Mn-Zn",
"density": 4.137694734310411,
"density_atomic": 0.08506631308179582,
"volume": 94.04427804820423,
"volume_molar": 7.0793485009858,
"formula_full": "Mn1 Zn1 F6",
"formula_reduced": "MnZnF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-8351",
"created_at": "2022-09-04T14:37:11.227032Z",
"updated_at": "2022-09-04T14:37:11.227055Z",
"structure_string": "Ca1 Mn1 F6\n1.0\n4.655232 0.119871 3.147186\n1.733667 4.322031 3.147186\n0.172414 0.119871 5.616603\nCa Mn F\n1 1 6\ndirect\n0.500000 0.500000 0.500001 Ca\n0.000000 0.000000 0.000000 Mn\n0.368984 0.065375 0.788211 F\n0.065376 0.788211 0.368985 F\n0.211789 0.631015 0.934625 F\n0.934624 0.211789 0.631017 F\n0.631016 0.934624 0.211790 F\n0.788211 0.368984 0.065376 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Mn",
"F"
],
"chemical_system": "Ca-F-Mn",
"density": 3.200015113265568,
"density_atomic": 0.07376208779621936,
"volume": 108.45679994987935,
"volume_molar": 8.16427644596668,
"formula_full": "Ca1 Mn1 F6",
"formula_reduced": "CaMnF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0370599195474136,
"spacegroup": 148
},
{
"id": "jvasp-8350",
"created_at": "2022-09-04T14:37:01.441913Z",
"updated_at": "2022-09-04T14:37:01.441940Z",
"structure_string": "Ca1 W1 F6\n1.0\n4.884937 0.184649 3.402644\n1.874391 4.514794 3.402645\n0.265586 0.184649 5.947273\nCa W F\n1 1 6\ndirect\n0.500001 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 W\n0.374691 0.086996 0.771442 F\n0.086996 0.771443 0.374689 F\n0.228557 0.625310 0.913003 F\n0.913006 0.228556 0.625308 F\n0.625311 0.913004 0.228555 F\n0.771444 0.374690 0.086994 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"W",
"F"
],
"chemical_system": "Ca-F-W",
"density": 4.550733847803893,
"density_atomic": 0.06488186323885971,
"volume": 123.30102128153061,
"volume_molar": 9.281701325114161,
"formula_full": "Ca1 W1 F6",
"formula_reduced": "CaWF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.5721177643750001,
"spacegroup": 148
},
{
"id": "jvasp-8349",
"created_at": "2022-09-04T14:37:07.747488Z",
"updated_at": "2022-09-04T14:37:07.747499Z",
"structure_string": "Zn1 Co1 F6\n1.0\n4.354231 0.081312 2.891265\n1.592691 4.053303 2.891265\n0.116953 0.081312 5.225424\nZn Co F\n1 1 6\ndirect\n0.500000 0.499999 0.500001 Zn\n0.000000 0.000000 0.000000 Co\n0.382788 0.083150 0.770895 F\n0.083150 0.770894 0.382790 F\n0.229105 0.617210 0.916851 F\n0.916850 0.229104 0.617212 F\n0.617211 0.916849 0.229107 F\n0.770895 0.382788 0.083151 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zn",
"Co",
"F"
],
"chemical_system": "Co-F-Zn",
"density": 4.4192122601055965,
"density_atomic": 0.08933101624283048,
"volume": 89.55456163459982,
"volume_molar": 6.741377198295697,
"formula_full": "Zn1 Co1 F6",
"formula_reduced": "ZnCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.00152,
"spacegroup": 148
},
{
"id": "jvasp-8348",
"created_at": "2022-09-04T14:37:09.110345Z",
"updated_at": "2022-09-04T14:37:09.110367Z",
"structure_string": "Zn1 W1 F6\n1.0\n4.615146 0.134386 3.146542\n1.733313 4.279400 3.146542\n0.193291 0.134386 5.582376\nZn W F\n1 1 6\ndirect\n0.500000 0.500001 0.500000 Zn\n0.000000 0.000000 0.000000 W\n0.390020 0.101121 0.756667 F\n0.101119 0.756668 0.390020 F\n0.243332 0.609981 0.898880 F\n0.898880 0.243334 0.609979 F\n0.609980 0.898881 0.243332 F\n0.756667 0.390021 0.101119 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zn",
"W",
"F"
],
"chemical_system": "F-W-Zn",
"density": 5.732913457958975,
"density_atomic": 0.07603670746241119,
"volume": 105.21234107821945,
"volume_molar": 7.920044095777097,
"formula_full": "Zn1 W1 F6",
"formula_reduced": "ZnWF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.4874340118749999,
"spacegroup": 148
},
{
"id": "jvasp-8347",
"created_at": "2022-09-04T14:37:02.772755Z",
"updated_at": "2022-09-04T14:37:02.772785Z",
"structure_string": "Ca1 Ni1 F6\n1.0\n4.568630 0.119713 3.092164\n1.703358 4.240905 3.092164\n0.172187 0.119713 5.514001\nCa Ni F\n1 1 6\ndirect\n0.500001 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Ni\n0.380814 0.043742 0.799102 F\n0.043743 0.799103 0.380812 F\n0.200899 0.619187 0.956256 F\n0.956258 0.200897 0.619186 F\n0.619187 0.956258 0.200896 F\n0.799102 0.380813 0.043742 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Ni",
"F"
],
"chemical_system": "Ca-F-Ni",
"density": 3.4483301268055033,
"density_atomic": 0.07808291730473337,
"volume": 102.45518835801799,
"volume_molar": 7.7124945735537205,
"formula_full": "Ca1 Ni1 F6",
"formula_reduced": "CaNiF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-8346",
"created_at": "2022-09-04T14:36:52.841224Z",
"updated_at": "2022-09-04T14:36:52.841253Z",
"structure_string": "Ca1 Co1 F6\n1.0\n4.585154 0.116937 3.097888\n1.706511 4.257361 3.097887\n0.168193 0.116937 5.531025\nCa Co F\n1 1 6\ndirect\n0.499999 0.500001 0.500001 Ca\n0.000000 0.000000 0.000000 Co\n0.377358 0.050010 0.795542 F\n0.050008 0.795541 0.377361 F\n0.204458 0.622641 0.949993 F\n0.949989 0.204461 0.622642 F\n0.622639 0.949991 0.204461 F\n0.795540 0.377360 0.050010 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Co",
"F"
],
"chemical_system": "Ca-Co-F",
"density": 3.411916464529498,
"density_atomic": 0.07717140095873998,
"volume": 103.66534623723152,
"volume_molar": 7.803591337184307,
"formula_full": "Ca1 Co1 F6",
"formula_reduced": "CaCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
}
]
}