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=-created_at&page=832",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=830",
"results": [
{
"id": "jvasp-15846",
"created_at": "2022-09-04T14:38:28.356755Z",
"updated_at": "2022-09-04T14:38:28.356786Z",
"structure_string": "La1\n1.0\n3.418991 0.000000 -1.208796\n-1.709496 2.960933 -1.208796\n-0.000000 -0.000000 3.626388\nLa\n1\ndirect\n0.000000 0.000000 0.000000 La\n",
"nsites": 1,
"nelements": 1,
"elements": [
"La"
],
"chemical_system": "La",
"density": 6.283008379840477,
"density_atomic": 0.02723950386743921,
"volume": 36.711388168686575,
"volume_molar": 22.108114704682922,
"formula_full": "La1",
"formula_reduced": "La",
"formula_anonymous": "A",
"energy_above_hull": 0.1168599999999999,
"spacegroup": 229
},
{
"id": "jvasp-1014",
"created_at": "2022-09-04T14:38:28.353834Z",
"updated_at": "2022-09-04T14:38:28.353864Z",
"structure_string": "Ta1\n1.0\n2.703977 -0.000000 -0.956000\n-1.351989 2.341713 -0.956000\n-0.000000 -0.000000 2.868001\nTa\n1\ndirect\n0.000000 0.000000 -0.000000 Ta\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ta"
],
"chemical_system": "Ta",
"density": 16.545756863690446,
"density_atomic": 0.05506606479629038,
"volume": 18.16000478151776,
"volume_molar": 10.936210499657298,
"formula_full": "Ta1",
"formula_reduced": "Ta",
"formula_anonymous": "A",
"energy_above_hull": 8.000000004670937e-07,
"spacegroup": 229
},
{
"id": "jvasp-111964",
"created_at": "2022-09-04T14:38:28.352306Z",
"updated_at": "2022-09-04T14:38:28.352331Z",
"structure_string": "Li3 V3 C6 O18\n1.0\n7.982813 0.046029 0.020881\n4.061968 6.872251 0.020881\n0.009157 0.005260 5.231600\nLi V C O\n3 3 6 18\ndirect\n0.665507 0.001102 0.499837 Li\n-0.001101 0.334493 0.500163 Li\n0.332189 0.667811 0.500000 Li\n0.326384 0.006939 0.000013 V\n0.993061 0.673616 -0.000013 V\n0.659707 0.340293 -0.000000 V\n0.334507 0.333093 0.760362 C\n0.333554 0.332175 0.239583 C\n0.000218 0.998838 0.239613 C\n0.666907 0.665493 0.239638 C\n0.667825 0.666446 0.760417 C\n0.001162 0.999782 0.760387 C\n0.231507 0.520716 0.233269 O\n0.522152 0.242269 0.240322 O\n0.247096 0.231174 0.240549 O\n0.435508 0.419555 0.759406 O\n0.102172 0.086237 0.759442 O\n0.898165 0.187375 0.233311 O\n0.145964 0.435158 0.766641 O\n0.855502 0.575590 0.240345 O\n0.564843 0.854036 0.233358 O\n0.757731 0.477849 0.759678 O\n0.768827 0.752904 0.759450 O\n0.580445 0.564492 0.240593 O\n0.913764 0.897828 0.240557 O\n0.424410 0.144498 0.759655 O\n0.479284 0.768493 0.766730 O\n0.188818 0.908928 0.240356 O\n0.091072 0.811183 0.759643 O\n0.812625 0.101835 0.766689 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Li",
"V",
"C",
"O"
],
"chemical_system": "C-Li-O-V",
"density": 3.098438052524809,
"density_atomic": 0.10488588324411427,
"volume": 286.02514534941923,
"volume_molar": 5.741612287312207,
"formula_full": "Li3 V3 C6 O18",
"formula_reduced": "LiV(CO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 3.60644352,
"spacegroup": 149
},
{
"id": "jvasp-109382",
"created_at": "2022-09-04T14:38:28.350749Z",
"updated_at": "2022-09-04T14:38:28.350776Z",
"structure_string": "Mn2 Co2 Si4\n1.0\n4.443315 0.000000 0.000000\n0.000000 4.501048 0.044523\n0.000000 -0.003051 4.506128\nMn Co Si\n2 2 4\ndirect\n0.636220 0.891366 0.871073 Mn\n0.136220 0.108634 0.128927 Mn\n0.365127 0.389335 0.635261 Co\n0.865126 0.610665 0.364739 Co\n0.658469 0.086926 0.350182 Si\n0.158470 0.913075 0.649818 Si\n0.340182 0.587149 0.157238 Si\n0.840181 0.412852 0.842762 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Si"
],
"chemical_system": "Co-Mn-Si",
"density": 6.266264617116093,
"density_atomic": 0.08876930244325525,
"volume": 90.12124439204541,
"volume_molar": 6.784035239940727,
"formula_full": "Mn2 Co2 Si4",
"formula_reduced": "MnCoSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.342218835344827,
"spacegroup": 4
},
{
"id": "jvasp-20533",
"created_at": "2022-09-04T14:38:28.349262Z",
"updated_at": "2022-09-04T14:38:28.349295Z",
"structure_string": "Ca1 Ga4\n1.0\n4.099330 -0.000000 -1.535867\n-0.575432 4.058741 -1.535867\n-0.025922 -0.029857 6.169436\nCa Ga\n1 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.750000 0.250000 0.500000 Ga\n0.250001 0.749999 0.500000 Ga\n0.384822 0.384821 0.769642 Ga\n0.615179 0.615178 0.230357 Ga\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ca",
"Ga"
],
"chemical_system": "Ca-Ga",
"density": 5.1789631115041175,
"density_atomic": 0.048889307551028986,
"volume": 102.27185146325034,
"volume_molar": 12.31790970595011,
"formula_full": "Ca1 Ga4",
"formula_reduced": "CaGa4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.000142,
"spacegroup": 139
},
{
"id": "jvasp-36978",
"created_at": "2022-09-04T14:38:28.349246Z",
"updated_at": "2022-09-04T14:38:28.349270Z",
"structure_string": "Na2 Os2 O6\n1.0\n4.679485 -0.007130 2.672834\n1.548102 4.415995 2.672834\n-0.010071 -0.007130 5.389019\nNa Os O\n2 2 6\ndirect\n0.255689 0.255690 0.255690 Na\n0.755689 0.755691 0.755689 Na\n0.005699 0.005699 0.005699 Os\n0.505698 0.505700 0.505699 Os\n0.255710 0.833952 0.677449 O\n0.833950 0.677449 0.255712 O\n0.677449 0.255711 0.833951 O\n0.177448 0.333950 0.755712 O\n0.755711 0.177449 0.333950 O\n0.333948 0.755714 0.177448 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Os",
"O"
],
"chemical_system": "Na-O-Os",
"density": 7.773520674550357,
"density_atomic": 0.08960569567270252,
"volume": 111.60004869027986,
"volume_molar": 6.72071202035719,
"formula_full": "Na2 Os2 O6",
"formula_reduced": "NaOsO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.3790329000000003,
"spacegroup": 167
},
{
"id": "jvasp-16664",
"created_at": "2022-09-04T14:38:28.347981Z",
"updated_at": "2022-09-04T14:38:28.348007Z",
"structure_string": "Ba2 Zn2 Ge2\n1.0\n2.235148 -3.871391 -0.000000\n2.235148 3.871391 -0.000000\n0.000000 0.000000 9.739918\nBa Zn Ge\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.250000 Zn\n0.333333 0.666667 0.750000 Zn\n0.333333 0.666667 0.250000 Ge\n0.666667 0.333333 0.750000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Ge"
],
"chemical_system": "Ba-Ge-Zn",
"density": 5.425584889072276,
"density_atomic": 0.03559529797652688,
"volume": 168.5615893412851,
"volume_molar": 16.918360295708908,
"formula_full": "Ba2 Zn2 Ge2",
"formula_reduced": "BaZnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-29603",
"created_at": "2022-09-04T14:38:28.337533Z",
"updated_at": "2022-09-04T14:38:28.337548Z",
"structure_string": "Cd8 I16\n1.0\n4.287276 -0.000000 -0.000000\n-2.143638 3.712890 0.000000\n-0.000000 -0.000000 55.008032\nCd I\n8 16\ndirect\n0.666667 0.333333 0.906255 Cd\n0.666667 0.333333 0.781253 Cd\n0.000000 0.000000 0.281204 Cd\n0.666667 0.333333 0.531257 Cd\n0.666667 0.333333 0.406261 Cd\n0.000000 0.000000 0.156265 Cd\n0.666667 0.333333 0.031219 Cd\n0.666667 0.333333 0.656257 Cd\n0.000000 0.000000 0.874745 I\n0.000000 0.000000 0.749740 I\n0.333333 0.666667 0.937770 I\n0.333333 0.666667 0.312732 I\n0.000000 0.000000 0.624747 I\n0.333333 0.666667 0.187778 I\n0.333333 0.666667 0.437778 I\n0.666667 0.333333 0.124756 I\n0.333333 0.666667 0.062751 I\n0.000000 0.000000 0.374749 I\n0.333333 0.666667 0.687772 I\n0.333333 0.666667 0.562777 I\n-0.000000 -0.000000 -0.000286 I\n0.333333 0.666667 0.812772 I\n0.666667 0.333333 0.249704 I\n0.000000 0.000000 0.499745 I\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.555989782267704,
"density_atomic": 0.027408900133756155,
"volume": 875.6279851755951,
"volume_molar": 21.971479083844276,
"formula_full": "Cd8 I16",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001533333333333,
"spacegroup": 156
},
{
"id": "jvasp-117761",
"created_at": "2022-09-04T14:38:28.333479Z",
"updated_at": "2022-09-04T14:38:28.333501Z",
"structure_string": "Rb1 Ca1 Br1\n1.0\n6.191526 -0.000000 0.000000\n-3.095763 5.362019 0.000000\n0.000000 -0.000000 4.007685\nRb Ca Br\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Rb\n0.333334 0.666666 0.000000 Ca\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"Br"
],
"chemical_system": "Br-Ca-Rb",
"density": 2.564101375525255,
"density_atomic": 0.022547667719791768,
"volume": 133.0514551341679,
"volume_molar": 26.708486371359456,
"formula_full": "Rb1 Ca1 Br1",
"formula_reduced": "RbCaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-17292",
"created_at": "2022-09-04T14:38:28.327625Z",
"updated_at": "2022-09-04T14:38:28.327648Z",
"structure_string": "Nd1 Co1 Ge3\n1.0\n4.024992 0.000000 -1.613976\n-0.647186 3.972620 -1.613976\n-0.003717 -0.004372 5.816552\nNd Co Ge\n1 1 3\ndirect\n0.335192 0.335193 0.670385 Nd\n0.002083 0.002083 0.004166 Co\n0.593585 0.093586 0.187171 Ge\n0.771150 0.771152 0.542303 Ge\n0.093585 0.593586 0.187171 Ge\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Nd",
"density": 7.52293028959113,
"density_atomic": 0.05379323450513547,
"volume": 92.94849149706114,
"volume_molar": 11.194977984499307,
"formula_full": "Nd1 Co1 Ge3",
"formula_reduced": "NdCoGe3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.44839005,
"spacegroup": 107
},
{
"id": "jvasp-41398",
"created_at": "2022-09-04T14:38:28.313183Z",
"updated_at": "2022-09-04T14:38:28.313211Z",
"structure_string": "Fe6 Re2\n1.0\n2.546531 -4.410721 0.000000\n2.546531 4.410721 -0.000000\n0.000000 -0.000000 4.052505\nFe Re\n6 2\ndirect\n0.675796 0.837898 0.250000 Fe\n0.162101 0.837899 0.250000 Fe\n0.162101 0.324203 0.250000 Fe\n0.324203 0.162101 0.749999 Fe\n0.837899 0.162101 0.749999 Fe\n0.837898 0.675796 0.749999 Fe\n0.333333 0.666667 0.749999 Re\n0.666667 0.333333 0.250000 Re\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"Re"
],
"chemical_system": "Fe-Re",
"density": 12.904869296575283,
"density_atomic": 0.08787753721100143,
"volume": 91.03577835586493,
"volume_molar": 6.85287839318975,
"formula_full": "Fe6 Re2",
"formula_reduced": "Fe3Re",
"formula_anonymous": "AB3",
"energy_above_hull": 4.285138625,
"spacegroup": 194
},
{
"id": "jvasp-118701",
"created_at": "2022-09-04T14:38:28.304752Z",
"updated_at": "2022-09-04T14:38:28.304782Z",
"structure_string": "Mg1 Sb1 O1\n1.0\n4.591733 -0.000000 -0.000000\n-2.295866 3.976557 0.000000\n-0.000000 0.000000 3.245667\nMg Sb O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333334 0.000000 Sb\n0.333333 0.666668 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Sb",
"O"
],
"chemical_system": "Mg-O-Sb",
"density": 4.540973050476892,
"density_atomic": 0.05062131888333666,
"volume": 59.263568515745035,
"volume_molar": 11.896451718057364,
"formula_full": "Mg1 Sb1 O1",
"formula_reduced": "MgSbO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9291928833333336,
"spacegroup": 187
}
]
}