HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_anonymous&page=60",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_anonymous&page=58",
"results": [
{
"id": "mp-1196831",
"created_at": "2022-09-04T14:46:30.264556Z",
"structure_string": "S80\n1.0\n10.227076 0.000000 0.000000\n0.000000 14.090503 0.000000\n0.000000 6.956926 17.905648\nS\n80\ndirect\n0.012247 0.000000 0.000000 S\n0.512161 0.000000 0.500000 S\n0.194428 0.500000 0.000000 S\n0.695334 0.500000 0.500000 S\n0.631991 0.124931 0.450923 S\n0.631991 0.875069 0.549077 S\n0.676444 0.185273 0.531539 S\n0.676444 0.814727 0.468461 S\n0.528334 0.285674 0.530754 S\n0.528334 0.714326 0.469246 S\n0.575683 0.425048 0.449989 S\n0.575683 0.574952 0.550011 S\n0.050015 0.070549 0.457193 S\n0.050015 0.929451 0.542807 S\n0.190714 0.158185 0.482737 S\n0.190714 0.841815 0.517263 S\n0.104069 0.223393 0.551828 S\n0.104069 0.776607 0.448172 S\n0.015766 0.357147 0.483881 S\n0.015766 0.642853 0.516119 S\n0.156023 0.529433 0.542172 S\n0.156023 0.470567 0.457828 S\n0.805325 0.049069 0.302902 S\n0.805325 0.950931 0.697098 S\n0.723310 0.015293 0.768296 S\n0.723310 0.984707 0.231704 S\n0.865688 0.103727 0.791275 S\n0.865688 0.896273 0.208725 S\n0.859543 0.245230 0.706133 S\n0.859543 0.754770 0.293867 S\n0.719873 0.330770 0.734409 S\n0.719873 0.669230 0.265591 S\n0.811007 0.397733 0.801479 S\n0.811007 0.602267 0.198521 S\n0.896676 0.531160 0.732056 S\n0.896676 0.468840 0.267944 S\n0.755009 0.643758 0.706697 S\n0.755009 0.356242 0.293303 S\n0.758241 0.703521 0.790489 S\n0.758241 0.296479 0.209511 S\n0.897255 0.181861 0.237009 S\n0.897255 0.818139 0.762991 S\n0.382192 0.111231 0.282090 S\n0.382192 0.888769 0.717910 S\n0.233947 0.012131 0.280510 S\n0.233947 0.987869 0.719490 S\n0.282756 0.048768 0.799252 S\n0.282756 0.951232 0.200748 S\n0.399981 0.174554 0.747923 S\n0.399981 0.825446 0.252077 S\n0.278055 0.298610 0.700689 S\n0.278055 0.701390 0.299311 S\n0.238415 0.359079 0.781871 S\n0.238415 0.640921 0.218129 S\n0.386616 0.460804 0.778159 S\n0.386616 0.539196 0.221841 S\n0.334105 0.599892 0.698876 S\n0.334105 0.400108 0.301124 S\n0.217161 0.672862 0.751759 S\n0.217161 0.327138 0.248241 S\n0.339523 0.749038 0.799502 S\n0.339523 0.250962 0.200498 S\n0.604178 0.777113 0.947214 S\n0.604178 0.222887 0.052786 S\n0.690195 0.157846 0.983277 S\n0.690195 0.842154 0.016723 S\n0.548848 0.070754 0.957537 S\n0.548848 0.929246 0.042463 S\n0.514971 0.356252 0.985072 S\n0.514971 0.643748 0.014928 S\n0.654781 0.470053 0.958060 S\n0.654781 0.529947 0.041940 S\n0.174912 0.813774 0.969373 S\n0.174912 0.186226 0.030627 S\n0.131574 0.124924 0.950220 S\n0.131574 0.875076 0.049780 S\n0.026968 0.713113 0.970608 S\n0.026968 0.286887 0.029392 S\n0.075672 0.425975 0.948751 S\n0.075672 0.574025 0.051249 S\n",
"nsites": 80,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 1.6508298231044178,
"density_atomic": 0.031004302413772913,
"volume": 2580.2870495954758,
"volume_molar": 19.423564767336316,
"formula_full": "S80",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy": -330.07529879,
"energy_per_atom": -4.1259412348749995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -330.07529879,
"band_gap": 2.3187,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013068,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:37.240000Z",
"spacegroup": 3
},
{
"id": "mp-10661",
"created_at": "2022-09-04T14:40:43.658976Z",
"structure_string": "Tm1\n1.0\n-1.970482 1.970482 1.970482\n1.970482 -1.970482 1.970482\n1.970482 1.970482 -1.970482\nTm\n1\ndirect\n0.000000 0.000000 0.000000 Tm\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tm"
],
"chemical_system": "Tm",
"density": 9.166199288685815,
"density_atomic": 0.032675526389683796,
"volume": 30.603944618187285,
"volume_molar": 18.43012623019683,
"formula_full": "Tm1",
"formula_reduced": "Tm",
"formula_anonymous": "A",
"energy": -4.33507765,
"energy_per_atom": -4.33507765,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.33507765,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0308901,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:09.036000Z",
"spacegroup": 229
},
{
"id": "mp-1199894",
"created_at": "2022-09-04T14:42:58.558112Z",
"structure_string": "Si82\n1.0\n7.610454 12.741852 0.000000\n-7.610454 12.741852 0.000000\n0.000000 0.713534 9.876413\nSi\n82\ndirect\n0.454961 0.653551 0.100932 Si\n0.346449 0.545039 0.399068 Si\n0.545039 0.346449 0.899068 Si\n0.653551 0.454961 0.600932 Si\n0.599192 0.678725 0.106205 Si\n0.321275 0.400808 0.393795 Si\n0.400808 0.321275 0.893795 Si\n0.678725 0.599192 0.606205 Si\n0.724024 0.543009 0.233387 Si\n0.456991 0.275976 0.266613 Si\n0.275976 0.456991 0.766613 Si\n0.543009 0.724024 0.733387 Si\n0.884316 0.453219 0.119279 Si\n0.546781 0.115684 0.380721 Si\n0.115684 0.546781 0.880721 Si\n0.453219 0.884316 0.619279 Si\n0.554923 0.343050 0.140616 Si\n0.656950 0.445077 0.359384 Si\n0.445077 0.656950 0.859384 Si\n0.343050 0.554923 0.640616 Si\n0.955027 0.176265 0.992634 Si\n0.823735 0.044973 0.507366 Si\n0.044973 0.823735 0.007366 Si\n0.176265 0.955027 0.492634 Si\n0.930088 0.281174 0.177953 Si\n0.718826 0.069912 0.322047 Si\n0.069912 0.718826 0.822047 Si\n0.281174 0.930088 0.677953 Si\n0.823390 0.127038 0.995518 Si\n0.872962 0.176610 0.504482 Si\n0.176610 0.872962 0.004482 Si\n0.127038 0.823390 0.495518 Si\n0.794108 0.279775 0.312602 Si\n0.720225 0.205892 0.187398 Si\n0.205892 0.720225 0.687398 Si\n0.279775 0.794108 0.812602 Si\n0.351141 0.115820 0.096274 Si\n0.884180 0.648859 0.403726 Si\n0.648859 0.884180 0.903726 Si\n0.115820 0.351141 0.596274 Si\n0.347646 0.274944 0.103812 Si\n0.725056 0.652354 0.396188 Si\n0.652354 0.725056 0.896188 Si\n0.274944 0.347646 0.603812 Si\n0.601176 0.786724 0.266589 Si\n0.213276 0.398824 0.233411 Si\n0.398824 0.213276 0.733411 Si\n0.786724 0.601176 0.766589 Si\n0.450216 0.902851 0.378354 Si\n0.097149 0.549784 0.121646 Si\n0.549784 0.097149 0.621646 Si\n0.902851 0.450216 0.878354 Si\n0.486877 0.024666 0.253012 Si\n0.975334 0.513123 0.246988 Si\n0.513123 0.975334 0.746988 Si\n0.024666 0.486877 0.753012 Si\n0.640293 0.905619 0.142020 Si\n0.094381 0.359707 0.357980 Si\n0.359707 0.094381 0.857980 Si\n0.905619 0.640293 0.642020 Si\n0.292758 0.788112 0.182290 Si\n0.211888 0.707242 0.317710 Si\n0.707242 0.211888 0.817710 Si\n0.788112 0.292758 0.682290 Si\n0.291749 0.924626 0.303470 Si\n0.075374 0.708251 0.196530 Si\n0.708251 0.075374 0.696530 Si\n0.924626 0.291749 0.803470 Si\n0.131842 0.050744 0.997088 Si\n0.949256 0.868158 0.502912 Si\n0.868158 0.949256 0.002912 Si\n0.050744 0.131842 0.497088 Si\n0.214640 0.082396 0.174492 Si\n0.917604 0.785360 0.325508 Si\n0.785360 0.917604 0.825508 Si\n0.082396 0.214640 0.674492 Si\n0.080666 0.213616 0.301069 Si\n0.786384 0.919334 0.198931 Si\n0.919334 0.786384 0.698931 Si\n0.213616 0.080666 0.801069 Si\n0.498051 0.501949 0.250000 Si\n0.501949 0.498051 0.750000 Si\n",
"nsites": 82,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 1.996515793539283,
"density_atomic": 0.04280963181147445,
"volume": 1915.4567916190576,
"volume_molar": 14.067256608326772,
"formula_full": "Si82",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -434.30838375,
"energy_per_atom": -5.296443704268293,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -434.30838375,
"band_gap": 0.9985,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.9e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:01.375000Z",
"spacegroup": 15
},
{
"id": "mp-973986",
"created_at": "2022-09-04T14:44:55.030549Z",
"structure_string": "Ho4\n1.0\n1.770124 -3.065945 0.000000\n1.770124 3.065945 0.000000\n0.000000 0.000000 11.426988\nHo\n4\ndirect\n0.000000 0.000000 0.000000 Ho\n0.333333 0.666667 0.250000 Ho\n0.000000 0.000000 0.500000 Ho\n0.666667 0.333333 0.750000 Ho\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ho"
],
"chemical_system": "Ho",
"density": 8.832421234737389,
"density_atomic": 0.032250033799475386,
"volume": 124.03087776190388,
"volume_molar": 18.673285111713472,
"formula_full": "Ho4",
"formula_reduced": "Ho",
"formula_anonymous": "A",
"energy": -18.30788468,
"energy_per_atom": -4.57697117,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.30788468,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024091,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:48.283000Z",
"spacegroup": 194
},
{
"id": "mp-568938",
"created_at": "2022-09-04T14:47:44.180667Z",
"structure_string": "Pr1\n1.0\n-2.190241 2.190241 1.882178\n2.190241 -2.190241 1.882178\n2.190241 2.190241 -1.882178\nPr\n1\ndirect\n0.000000 0.000000 0.000000 Pr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pr"
],
"chemical_system": "Pr",
"density": 6.478570310382371,
"density_atomic": 0.027688249960993765,
"volume": 36.11640321828808,
"volume_molar": 21.749806392544777,
"formula_full": "Pr1",
"formula_reduced": "Pr",
"formula_anonymous": "A",
"energy": -4.69519808,
"energy_per_atom": -4.69519808,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.69519808,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000501,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:18.762000Z",
"spacegroup": 139
},
{
"id": "mp-974400",
"created_at": "2022-09-04T14:46:04.505326Z",
"structure_string": "Kr1\n1.0\n-2.506583 2.506583 2.506583\n2.506583 -2.506583 2.506583\n2.506583 2.506583 -2.506583\nKr\n1\ndirect\n0.000000 0.000000 0.000000 Kr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Kr"
],
"chemical_system": "Kr",
"density": 2.2089022111343932,
"density_atomic": 0.01587426912948227,
"volume": 62.99502621779063,
"volume_molar": 37.93649150634256,
"formula_full": "Kr1",
"formula_reduced": "Kr",
"formula_anonymous": "A",
"energy": -0.05441248,
"energy_per_atom": -0.05441248,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.05441248,
"band_gap": 7.1667,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:18.091000Z",
"spacegroup": 229
},
{
"id": "mp-1103107",
"created_at": "2022-09-04T14:45:54.823058Z",
"structure_string": "Li12\n1.0\n8.046617 2.787678 0.000000\n-8.046617 2.787678 0.000000\n0.000000 0.000000 5.406859\nLi\n12\ndirect\n0.755953 0.755953 0.597809 Li\n0.244047 0.244047 0.402191 Li\n0.744047 0.744047 0.097809 Li\n0.255953 0.255953 0.902191 Li\n0.781959 0.454821 0.753871 Li\n0.545179 0.218041 0.246129 Li\n0.045179 0.718041 0.253871 Li\n0.281959 0.954821 0.746129 Li\n0.218041 0.545179 0.246129 Li\n0.454821 0.781959 0.753871 Li\n0.954821 0.281959 0.746129 Li\n0.718041 0.045179 0.253871 Li\n",
"nsites": 12,
"nelements": 1,
"elements": [
"Li"
],
"chemical_system": "Li",
"density": 0.5701923810387176,
"density_atomic": 0.04947095202537607,
"volume": 242.5665872337491,
"volume_molar": 12.173084433287134,
"formula_full": "Li12",
"formula_reduced": "Li",
"formula_anonymous": "A",
"energy": -22.24252073,
"energy_per_atom": -1.8535433941666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.24252073,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007779,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:12.661000Z",
"spacegroup": 64
},
{
"id": "mp-41",
"created_at": "2022-09-04T14:46:54.311959Z",
"structure_string": "Zr1\n1.0\n-1.791637 1.791637 1.791637\n1.791637 -1.791637 1.791637\n1.791637 1.791637 -1.791637\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.5848843117904075,
"density_atomic": 0.04347003006623424,
"volume": 23.004354919385243,
"volume_molar": 13.853546341753638,
"formula_full": "Zr1",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy": -8.47313825,
"energy_per_atom": -8.47313825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.47313825,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0372375,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:47.625000Z",
"spacegroup": 229
},
{
"id": "mp-1245108",
"created_at": "2022-09-04T14:46:19.126803Z",
"structure_string": "Fe100\n1.0\n10.405638 0.047555 -0.110238\n0.044125 10.706984 0.183230\n-0.107483 0.189424 10.453722\nFe\n100\ndirect\n0.567781 0.461286 0.603950 Fe\n0.821536 0.247467 0.372452 Fe\n0.852598 0.822227 0.738120 Fe\n0.169268 0.655136 0.960521 Fe\n0.784930 0.192604 0.583042 Fe\n0.701780 0.767452 0.121921 Fe\n0.389336 0.447863 0.737528 Fe\n0.005843 0.480840 0.776838 Fe\n0.970474 0.350322 0.544878 Fe\n0.035037 0.285871 0.961872 Fe\n0.213263 0.422299 0.896792 Fe\n0.146441 0.100203 0.085120 Fe\n0.905459 0.248661 0.767064 Fe\n0.033310 0.071997 0.873410 Fe\n0.127892 0.618850 0.239258 Fe\n0.410993 0.542599 0.946840 Fe\n0.416493 0.171781 0.483713 Fe\n0.088448 0.832294 0.827977 Fe\n0.805615 0.173946 0.959576 Fe\n0.567580 0.990300 0.217917 Fe\n0.596353 0.660055 0.505777 Fe\n0.389127 0.976653 0.617121 Fe\n0.276858 0.500190 0.120583 Fe\n0.500982 0.210051 0.277421 Fe\n0.186191 0.005161 0.475483 Fe\n0.645086 0.033834 0.873418 Fe\n0.387549 0.785466 0.483820 Fe\n0.603507 0.286860 0.477774 Fe\n0.822959 0.042891 0.761049 Fe\n0.907512 0.902240 0.200198 Fe\n0.934780 0.114367 0.148778 Fe\n0.332930 0.357608 0.296611 Fe\n0.042868 0.209335 0.352023 Fe\n0.446553 0.314061 0.908417 Fe\n0.247490 0.815110 0.310962 Fe\n0.737443 0.867605 0.333521 Fe\n0.372380 0.387024 0.506270 Fe\n0.874585 0.323121 0.125569 Fe\n0.687779 0.389853 0.249257 Fe\n0.965943 0.574161 0.469061 Fe\n0.025641 0.812735 0.397888 Fe\n0.245494 0.950157 0.957674 Fe\n0.420546 0.988258 0.385122 Fe\n0.572483 0.872629 0.728206 Fe\n0.006203 0.124577 0.595512 Fe\n0.539216 0.596430 0.147528 Fe\n0.911262 0.667947 0.921723 Fe\n0.913873 0.904358 0.966488 Fe\n0.350036 0.603144 0.322633 Fe\n0.601792 0.455946 0.820371 Fe\n0.322446 0.245040 0.101241 Fe\n0.260865 0.147406 0.303573 Fe\n0.643417 0.243231 0.785679 Fe\n0.833799 0.426036 0.904930 Fe\n0.658683 0.347635 0.020263 Fe\n0.244861 0.630193 0.749796 Fe\n0.929325 0.449523 0.293318 Fe\n0.148794 0.436288 0.386344 Fe\n0.100570 0.988602 0.270445 Fe\n0.772862 0.393886 0.681428 Fe\n0.676656 0.604173 0.938632 Fe\n0.508084 0.784658 0.280209 Fe\n0.712127 0.819149 0.900556 Fe\n0.712321 0.172015 0.189515 Fe\n0.333476 0.735460 0.106445 Fe\n0.022230 0.506259 0.053572 Fe\n0.720359 0.621200 0.312070 Fe\n0.375923 0.590346 0.565148 Fe\n0.526917 0.478913 0.364838 Fe\n0.586679 0.881815 0.503075 Fe\n0.657545 0.080897 0.404023 Fe\n0.017084 0.682020 0.661106 Fe\n0.811117 0.739990 0.515962 Fe\n0.347591 0.822825 0.815258 Fe\n0.581629 0.089170 0.632887 Fe\n0.213431 0.818142 0.619670 Fe\n0.732134 0.984371 0.076596 Fe\n0.507430 0.729220 0.959269 Fe\n0.762209 0.614188 0.707250 Fe\n0.124025 0.268484 0.735300 Fe\n0.330285 0.971784 0.172717 Fe\n0.199718 0.235484 0.520046 Fe\n0.902859 0.028452 0.392534 Fe\n0.480330 0.394615 0.130763 Fe\n0.199724 0.032241 0.723477 Fe\n0.489599 0.920636 0.011505 Fe\n0.779448 0.964555 0.566165 Fe\n0.916461 0.687598 0.214644 Fe\n0.531234 0.147723 0.038824 Fe\n0.178563 0.650727 0.476062 Fe\n0.101594 0.825169 0.106866 Fe\n0.364109 0.232637 0.694368 Fe\n0.759712 0.467768 0.469509 Fe\n0.253753 0.180205 0.901113 Fe\n0.431806 0.059378 0.832784 Fe\n0.172311 0.460568 0.617059 Fe\n0.120773 0.330606 0.175994 Fe\n0.788002 0.535131 0.107742 Fe\n0.506368 0.657324 0.740024 Fe\n0.004164 0.909981 0.602834 Fe\n",
"nsites": 100,
"nelements": 1,
"elements": [
"Fe"
],
"chemical_system": "Fe",
"density": 7.965581247011818,
"density_atomic": 0.08589820310018596,
"volume": 1164.1687065719714,
"volume_molar": 7.010787819363548,
"formula_full": "Fe100",
"formula_reduced": "Fe",
"formula_anonymous": "A",
"energy": -819.05657127,
"energy_per_atom": -8.1905657127,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -819.05657127,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 205.3566831,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:28.320000Z",
"spacegroup": 1
},
{
"id": "mp-48",
"created_at": "2022-09-04T14:47:35.806291Z",
"structure_string": "C4\n1.0\n1.233862 -2.137112 0.000000\n1.233862 2.137112 0.000000\n0.000000 0.000000 8.685038\nC\n4\ndirect\n0.000000 0.000000 0.750000 C\n0.000000 0.000000 0.250000 C\n0.333333 0.666667 0.750000 C\n0.666667 0.333333 0.250000 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 1.7417339509645842,
"density_atomic": 0.08733018910475182,
"volume": 45.80317575176706,
"volume_molar": 6.895829290804,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -36.88118863,
"energy_per_atom": -9.2202971575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.88118863,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.8e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:17.511000Z",
"spacegroup": 194
},
{
"id": "mp-10654",
"created_at": "2022-09-04T14:40:09.085617Z",
"structure_string": "Te1\n1.0\n3.197462 0.000000 0.000000\n0.000000 3.197462 0.000000\n0.000000 0.000000 3.197462\nTe\n1\ndirect\n0.500000 0.500000 0.500000 Te\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Te"
],
"chemical_system": "Te",
"density": 6.481620453792556,
"density_atomic": 0.030590306221883155,
"volume": 32.69009446151401,
"volume_molar": 19.686435030493374,
"formula_full": "Te1",
"formula_reduced": "Te",
"formula_anonymous": "A",
"energy": -3.09675431,
"energy_per_atom": -3.09675431,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.09675431,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001527,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.250000Z",
"spacegroup": 221
},
{
"id": "mp-8632",
"created_at": "2022-09-04T14:42:47.362829Z",
"structure_string": "V1\n1.0\n0.000000 1.909544 1.909544\n1.909544 0.000000 1.909544\n1.909544 1.909544 0.000000\nV\n1\ndirect\n0.000000 0.000000 0.000000 V\n",
"nsites": 1,
"nelements": 1,
"elements": [
"V"
],
"chemical_system": "V",
"density": 6.0743780976875925,
"density_atomic": 0.07180934983535475,
"volume": 13.92576318115692,
"volume_molar": 8.386290606735237,
"formula_full": "V1",
"formula_reduced": "V",
"formula_anonymous": "A",
"energy": -8.83676567,
"energy_per_atom": -8.83676567,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.83676567,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020693,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.043000Z",
"spacegroup": 225
}
]
}