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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=spacegroup&page=358",
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"results": [
{
"id": "oqmd-1103104",
"created_at": "2022-09-04T15:34:57.566395Z",
"updated_at": "2022-09-04T15:34:57.566412Z",
"structure_string": "Ho8 Si8 O28\n1.0\n6.579039 -0.019890 -0.025769\n-0.186651 6.609969 -0.002088\n-0.164837 -0.900139 11.940841\nHo O Si\n8 28 8\ndirect\n0.326383 0.827313 0.109061 Ho\n0.051618 0.328146 0.114837 Ho\n0.116246 0.088654 0.357801 Ho\n0.629305 0.780001 0.368094 Ho\n0.370695 0.219999 0.631905 Ho\n0.883754 0.911346 0.642200 Ho\n0.948382 0.671854 0.885163 Ho\n0.673617 0.172687 0.890939 Ho\n0.237025 0.087633 0.005396 O\n0.999743 0.665033 0.082187 O\n0.703229 0.292259 0.091139 O\n0.355333 0.489345 0.123226 O\n0.999454 0.015167 0.184653 O\n0.648780 0.788394 0.187490 O\n0.384310 0.136804 0.212482 O\n0.601900 0.434259 0.303862 O\n0.072821 0.413799 0.310943 O\n0.287051 0.781235 0.311839 O\n0.774182 0.092916 0.375938 O\n0.960746 0.770695 0.425856 O\n0.412446 0.169328 0.445975 O\n0.289812 0.572040 0.489469 O\n0.710188 0.427960 0.510531 O\n0.587554 0.830672 0.554026 O\n0.039254 0.229305 0.574144 O\n0.225818 0.907084 0.624062 O\n0.712949 0.218765 0.688162 O\n0.927179 0.586201 0.689058 O\n0.398100 0.565741 0.696138 O\n0.615690 0.863196 0.787517 O\n0.351220 0.211606 0.812510 O\n0.000546 0.984833 0.815346 O\n0.644667 0.510655 0.876775 O\n0.296771 0.707741 0.908862 O\n0.000257 0.334966 0.917814 O\n0.762975 0.912367 0.994604 O\n0.842903 0.850970 0.115925 Si\n0.513746 0.334137 0.173055 Si\n0.143479 0.624162 0.380461 Si\n0.621907 0.273719 0.403744 Si\n0.378093 0.726281 0.596257 Si\n0.856521 0.375838 0.619540 Si\n0.486254 0.665864 0.826945 Si\n0.157097 0.149030 0.884076 Si\n",
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"elements": [
"Ho",
"O",
"Si"
],
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"density": 6.371476625277892,
"density_atomic": 0.08474818578210545,
"volume": 519.185155339226,
"volume_molar": 7.105922922625646,
"formula_full": "Ho8 Si8 O28",
"formula_reduced": "Ho2Si2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -3.49426572798345,
"spacegroup": 2
},
{
"id": "oqmd-1103025",
"created_at": "2022-09-04T15:34:57.642539Z",
"updated_at": "2022-09-04T15:34:57.642548Z",
"structure_string": "Gd8 Ge8 O28\n1.0\n12.313757 0.004960 -0.146270\n-0.485077 6.816060 -0.066391\n-0.121541 -0.187289 6.819196\nGd Ge O\n8 8 28\ndirect\n0.114463 0.329544 0.045580 Gd\n0.360818 0.081868 0.113766 Gd\n0.115793 0.830283 0.315741 Gd\n0.629310 0.231415 0.371505 Gd\n0.370690 0.768586 0.628496 Gd\n0.884207 0.169717 0.684260 Gd\n0.639182 0.918133 0.886235 Gd\n0.885538 0.670456 0.954419 Gd\n0.381242 0.614776 0.141556 Ge\n0.884541 0.147601 0.166288 Ge\n0.602693 0.734646 0.384484 Ge\n0.835956 0.670282 0.488715 Ge\n0.164044 0.329717 0.511284 Ge\n0.397307 0.265354 0.615516 Ge\n0.115459 0.852399 0.833713 Ge\n0.618758 0.385225 0.858444 Ge\n0.082707 0.661009 0.000295 O\n0.185939 0.017589 0.006996 O\n0.571816 0.225771 0.041346 O\n0.307375 0.397699 0.065738 O\n0.622439 0.921640 0.223238 O\n0.016118 0.096976 0.241883 O\n0.312133 0.783706 0.289692 O\n0.919698 0.722671 0.293230 O\n0.492747 0.556705 0.300288 O\n0.116896 0.491393 0.342809 O\n0.811266 0.211552 0.367707 O\n0.702708 0.557214 0.386984 O\n0.221937 0.131810 0.388800 O\n0.449046 0.158495 0.404361 O\n0.550954 0.841504 0.595639 O\n0.778064 0.868191 0.611199 O\n0.297292 0.442786 0.613015 O\n0.188734 0.788449 0.632292 O\n0.883104 0.508607 0.657190 O\n0.507253 0.443295 0.699712 O\n0.080302 0.277329 0.706769 O\n0.687867 0.216294 0.710309 O\n0.983882 0.903026 0.758118 O\n0.377561 0.078361 0.776763 O\n0.692625 0.602301 0.934262 O\n0.428183 0.774229 0.958654 O\n0.814061 0.982411 0.993005 O\n0.917293 0.338991 0.999704 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Gd",
"Ge",
"O"
],
"chemical_system": "Gd-Ge-O",
"density": 6.638706726320164,
"density_atomic": 0.07691327443813163,
"volume": 572.0729005679406,
"volume_molar": 7.829780755003686,
"formula_full": "Gd8 Ge8 O28",
"formula_reduced": "Gd2Ge2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -2.85155901260466,
"spacegroup": 2
},
{
"id": "oqmd-1103106",
"created_at": "2022-09-04T15:34:57.583209Z",
"updated_at": "2022-09-04T15:34:57.583237Z",
"structure_string": "Tb8 Si8 O28\n1.0\n6.614187 -0.009807 -0.008527\n-0.177379 6.648878 0.000092\n-0.135502 -0.900912 12.007711\nO Si Tb\n28 8 8\ndirect\n0.239777 0.089800 0.003570 O\n0.000291 0.665308 0.081882 O\n0.702296 0.290676 0.091689 O\n0.358069 0.489586 0.124236 O\n0.999658 0.013226 0.183925 O\n0.651900 0.786709 0.188429 O\n0.381715 0.138487 0.211676 O\n0.602527 0.430047 0.303336 O\n0.286435 0.779462 0.312812 O\n0.072695 0.416541 0.313279 O\n0.774121 0.091456 0.375849 O\n0.962787 0.770680 0.429015 O\n0.415062 0.168522 0.444752 O\n0.291238 0.572914 0.490493 O\n0.708761 0.427086 0.509507 O\n0.584939 0.831478 0.555247 O\n0.037212 0.229320 0.570984 O\n0.225878 0.908544 0.624152 O\n0.927305 0.583459 0.686721 O\n0.713565 0.220538 0.687188 O\n0.397472 0.569953 0.696665 O\n0.618285 0.861513 0.788324 O\n0.348099 0.213291 0.811572 O\n0.000342 0.986773 0.816076 O\n0.641930 0.510414 0.875764 O\n0.297705 0.709324 0.908312 O\n0.999708 0.334692 0.918118 O\n0.760222 0.910200 0.996430 O\n0.843964 0.849931 0.116432 Si\n0.513801 0.333303 0.173484 Si\n0.144254 0.624790 0.382320 Si\n0.623370 0.272143 0.403402 Si\n0.376629 0.727858 0.596599 Si\n0.855746 0.375210 0.617680 Si\n0.486198 0.666697 0.826517 Si\n0.156035 0.150068 0.883568 Si\n0.329249 0.827443 0.107758 Tb\n0.052984 0.328288 0.115523 Tb\n0.116964 0.088619 0.358673 Tb\n0.629345 0.775806 0.369232 Tb\n0.370656 0.224194 0.630768 Tb\n0.883037 0.911381 0.641327 Tb\n0.947015 0.671712 0.884478 Tb\n0.670750 0.172557 0.892242 Tb\n",
"nsites": 44,
"nelements": 3,
"elements": [
"O",
"Si",
"Tb"
],
"chemical_system": "O-Si-Tb",
"density": 6.113643396613228,
"density_atomic": 0.08332815837686887,
"volume": 528.0327905604355,
"volume_molar": 7.227017706023959,
"formula_full": "Tb8 Si8 O28",
"formula_reduced": "Tb2Si2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -3.36541979868042,
"spacegroup": 2
},
{
"id": "oqmd-1103112",
"created_at": "2022-09-04T15:34:57.908756Z",
"updated_at": "2022-09-04T15:34:57.908791Z",
"structure_string": "Pm8 Si8 O28\n1.0\n6.705664 0.012442 0.014943\n-0.157391 6.755267 0.027447\n-0.097605 -0.865401 12.152469\nO Pm Si\n28 8 8\ndirect\n0.242629 0.093609 0.000000 O\n0.757370 0.906391 0.000000 O\n0.000509 0.664269 0.081674 O\n0.696911 0.283078 0.091802 O\n0.362727 0.486732 0.126838 O\n0.998408 0.004965 0.183652 O\n0.657324 0.782099 0.189864 O\n0.373674 0.138420 0.209586 O\n0.607078 0.411344 0.299783 O\n0.290892 0.769407 0.317543 O\n0.074919 0.418493 0.320184 O\n0.773268 0.081134 0.379361 O\n0.971020 0.765941 0.434535 O\n0.418616 0.170499 0.443733 O\n0.292228 0.572734 0.497433 O\n0.707772 0.427266 0.502567 O\n0.581383 0.829501 0.556267 O\n0.028980 0.234059 0.565465 O\n0.226732 0.918867 0.620639 O\n0.925082 0.581507 0.679815 O\n0.709109 0.230593 0.682457 O\n0.392922 0.588656 0.700217 O\n0.626326 0.861580 0.790414 O\n0.342676 0.217901 0.810137 O\n0.001591 0.995035 0.816347 O\n0.637273 0.513269 0.873162 O\n0.303089 0.716923 0.908198 O\n0.999491 0.335731 0.918326 O\n0.335473 0.825408 0.105474 Pm\n0.053640 0.325797 0.117567 Pm\n0.119310 0.081386 0.361299 Pm\n0.636798 0.751858 0.372167 Pm\n0.363203 0.248142 0.627832 Pm\n0.880690 0.918614 0.638701 Pm\n0.946360 0.674203 0.882433 Pm\n0.664528 0.174592 0.894526 Pm\n0.845785 0.845575 0.117434 Si\n0.511826 0.326017 0.173549 Si\n0.149129 0.620658 0.387711 Si\n0.626918 0.262304 0.402178 Si\n0.373083 0.737695 0.597822 Si\n0.850871 0.379341 0.612288 Si\n0.488174 0.673982 0.826451 Si\n0.154216 0.154425 0.882566 Si\n",
"nsites": 44,
"nelements": 3,
"elements": [
"O",
"Pm",
"Si"
],
"chemical_system": "O-Pm-Si",
"density": 5.526244778861552,
"density_atomic": 0.0799006089887398,
"volume": 550.6841631983158,
"volume_molar": 7.537039875188794,
"formula_full": "Pm8 Si8 O28",
"formula_reduced": "Pm2Si2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -3.44585620533194,
"spacegroup": 2
},
{
"id": "oqmd-1103100",
"created_at": "2022-09-04T15:34:58.608061Z",
"updated_at": "2022-09-04T15:34:58.608089Z",
"structure_string": "Nd8 Si8 O28\n1.0\n6.732688 0.019632 0.021837\n-0.150888 6.791143 0.027748\n-0.086650 -0.869558 12.210262\nNd O Si\n8 28 8\ndirect\n0.339809 0.825195 0.104373 Nd\n0.054025 0.326342 0.118178 Nd\n0.119817 0.080650 0.361506 Nd\n0.638170 0.747673 0.372790 Nd\n0.361830 0.252327 0.627210 Nd\n0.880183 0.919349 0.638494 Nd\n0.945975 0.673659 0.881822 Nd\n0.660191 0.174805 0.895626 Nd\n0.754066 0.904170 0.001407 O\n0.002245 0.665316 0.080742 O\n0.696019 0.281392 0.092328 O\n0.365119 0.486205 0.128243 O\n0.998416 0.003867 0.182694 O\n0.661367 0.779096 0.190440 O\n0.373071 0.138579 0.209252 O\n0.608386 0.406874 0.299512 O\n0.291636 0.767499 0.318381 O\n0.075198 0.420515 0.321998 O\n0.773089 0.079455 0.379936 O\n0.973139 0.765984 0.435820 O\n0.419871 0.170286 0.443271 O\n0.292843 0.573884 0.498502 O\n0.707157 0.426117 0.501498 O\n0.580129 0.829714 0.556729 O\n0.026861 0.234016 0.564180 O\n0.226911 0.920544 0.620065 O\n0.924802 0.579484 0.678002 O\n0.708364 0.232502 0.681619 O\n0.391614 0.593126 0.700488 O\n0.626929 0.861421 0.790749 O\n0.338633 0.220904 0.809560 O\n0.001584 0.996133 0.817306 O\n0.634881 0.513796 0.871758 O\n0.303981 0.718609 0.907672 O\n0.997755 0.334684 0.919257 O\n0.245934 0.095829 0.998593 O\n0.847227 0.844634 0.117394 Si\n0.512198 0.324713 0.174188 Si\n0.150265 0.620980 0.388930 Si\n0.627718 0.260154 0.402111 Si\n0.372282 0.739844 0.597888 Si\n0.849735 0.379019 0.611070 Si\n0.487802 0.675286 0.825812 Si\n0.152773 0.155367 0.882606 Si\n",
"nsites": 44,
"nelements": 3,
"elements": [
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],
"chemical_system": "Nd-O-Si",
"density": 5.4308811704082345,
"density_atomic": 0.07878248315204463,
"volume": 558.4997862416079,
"volume_molar": 7.644009834492897,
"formula_full": "Nd8 Si8 O28",
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"formula_anonymous": "A2B2C7",
"formation_energy": -3.42819573465012,
"spacegroup": 2
},
{
"id": "oqmd-1103005",
"created_at": "2022-09-04T15:34:58.649768Z",
"updated_at": "2022-09-04T15:34:58.649799Z",
"structure_string": "Tm8 Ge8 O28\n1.0\n11.918144 -0.082094 -0.430360\n-0.515311 6.713999 -0.114662\n-0.271965 -0.243682 6.747531\nGe O Tm\n8 28 8\ndirect\n0.389388 0.614654 0.149540 Ge\n0.888062 0.147592 0.175741 Ge\n0.624198 0.759264 0.416594 Ge\n0.849519 0.668327 0.490790 Ge\n0.150481 0.331672 0.509209 Ge\n0.375802 0.240734 0.583408 Ge\n0.111937 0.852408 0.824259 Ge\n0.610612 0.385347 0.850460 Ge\n0.188124 0.027074 0.002028 O\n0.915244 0.339002 0.004992 O\n0.567885 0.225420 0.038623 O\n0.308513 0.392330 0.069293 O\n0.622026 0.938091 0.239332 O\n0.028421 0.100957 0.240455 O\n0.316072 0.786278 0.291741 O\n0.933470 0.727980 0.298245 O\n0.506306 0.563703 0.309291 O\n0.114299 0.490477 0.325756 O\n0.713580 0.555545 0.370956 O\n0.816187 0.215519 0.376958 O\n0.449689 0.163792 0.381568 O\n0.230860 0.134148 0.420506 O\n0.769139 0.865851 0.579495 O\n0.550311 0.836208 0.618431 O\n0.183812 0.784479 0.623044 O\n0.286421 0.444455 0.629043 O\n0.885701 0.509522 0.674246 O\n0.493694 0.436298 0.690708 O\n0.066529 0.272019 0.701756 O\n0.683928 0.213722 0.708259 O\n0.971580 0.899044 0.759544 O\n0.377974 0.061908 0.760668 O\n0.691488 0.607670 0.930707 O\n0.432114 0.774579 0.961375 O\n0.084756 0.660998 0.995008 O\n0.811877 0.972926 0.997972 O\n0.116307 0.334121 0.033358 Tm\n0.369098 0.081626 0.086904 Tm\n0.127082 0.830813 0.306336 Tm\n0.626308 0.252409 0.367327 Tm\n0.373691 0.747590 0.632673 Tm\n0.872918 0.169186 0.693665 Tm\n0.630902 0.918375 0.913097 Tm\n0.883694 0.665879 0.966642 Tm\n",
"nsites": 44,
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"elements": [
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],
"chemical_system": "Ge-O-Tm",
"density": 7.341303568991079,
"density_atomic": 0.08171363878253926,
"volume": 538.4658014936181,
"volume_molar": 7.369811025092696,
"formula_full": "Tm8 Ge8 O28",
"formula_reduced": "Tm2Ge2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -2.8786997089683,
"spacegroup": 2
},
{
"id": "oqmd-1103090",
"created_at": "2022-09-04T15:34:58.654573Z",
"updated_at": "2022-09-04T15:34:58.654603Z",
"structure_string": "Tm8 Si8 O28\n1.0\n6.529577 -0.042293 -0.051337\n-0.207992 6.548137 -0.007125\n-0.207429 -0.901478 11.843101\nO Si Tm\n28 8 8\ndirect\n0.232837 0.084775 0.008157 O\n0.998690 0.663948 0.082316 O\n0.702584 0.292912 0.090733 O\n0.351028 0.488309 0.122111 O\n0.644293 0.788831 0.185037 O\n0.998808 0.016519 0.185992 O\n0.387233 0.134804 0.215211 O\n0.600725 0.440730 0.304801 O\n0.070199 0.410367 0.307508 O\n0.287504 0.783254 0.310504 O\n0.775165 0.096685 0.376365 O\n0.958788 0.772369 0.421896 O\n0.411500 0.169436 0.448192 O\n0.285769 0.567928 0.487858 O\n0.714232 0.432071 0.512142 O\n0.588501 0.830563 0.551808 O\n0.041213 0.227631 0.578104 O\n0.224836 0.903314 0.623635 O\n0.712495 0.216745 0.689495 O\n0.929802 0.589633 0.692492 O\n0.399275 0.559271 0.695199 O\n0.612766 0.865195 0.784790 O\n0.001194 0.983481 0.814008 O\n0.355707 0.211168 0.814964 O\n0.648971 0.511691 0.877889 O\n0.297417 0.707089 0.909267 O\n0.001311 0.336051 0.917684 O\n0.767164 0.915224 0.991842 O\n0.841609 0.851319 0.114767 Si\n0.512645 0.335200 0.172997 Si\n0.141374 0.623272 0.377836 Si\n0.621173 0.277384 0.404743 Si\n0.378827 0.722615 0.595257 Si\n0.858627 0.376729 0.622164 Si\n0.487354 0.664801 0.827004 Si\n0.158391 0.148681 0.885233 Si\n0.322718 0.826672 0.110646 Tm\n0.048041 0.327270 0.114346 Tm\n0.116496 0.089149 0.357506 Tm\n0.628578 0.786607 0.366257 Tm\n0.371421 0.213394 0.633742 Tm\n0.883505 0.910852 0.642494 Tm\n0.951959 0.672730 0.885654 Tm\n0.677283 0.173328 0.889354 Tm\n",
"nsites": 44,
"nelements": 3,
"elements": [
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"Si",
"Tm"
],
"chemical_system": "O-Si-Tm",
"density": 6.640718531885147,
"density_atomic": 0.08693164862400361,
"volume": 506.1447780693612,
"volume_molar": 6.927443405619669,
"formula_full": "Tm8 Si8 O28",
"formula_reduced": "Tm2Si2O7",
"formula_anonymous": "A2B2C7",
"formation_energy": -3.50386587237739,
"spacegroup": 2
},
{
"id": "oqmd-1103108",
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}