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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=9",
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"results": [
{
"id": "oqmd-1557955",
"created_at": "2022-09-04T15:55:41.446730Z",
"updated_at": "2022-09-04T15:55:41.446748Z",
"structure_string": "Tb2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.723774 -1.922005 0.000000\n7.723774 1.922005 0.000000\n-1.491332 0.000000 9.451524\nDy Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.948331 0.948331 0.235771 Dy\n0.051669 0.051669 0.764229 Dy\n0.606242 0.606242 0.440923 Ho\n0.393758 0.393758 0.559077 Ho\n0.092898 0.092898 0.304287 N\n0.907102 0.907102 0.695713 N\n0.460868 0.460868 0.361505 O\n0.539132 0.539132 0.638495 O\n0.367504 0.367504 0.031560 S\n0.632496 0.632496 0.968440 S\n0.785076 0.785076 0.351410 Se\n0.214924 0.214924 0.648590 Se\n0.192389 0.192389 0.166318 Tb\n0.807611 0.807611 0.833682 Tb\n",
"nsites": 14,
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"elements": [
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"formula_full": "Tb2 Dy2 Ho2 Se2 S2 N2 O2",
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},
{
"id": "oqmd-1557949",
"created_at": "2022-09-04T15:55:41.480770Z",
"updated_at": "2022-09-04T15:55:41.480794Z",
"structure_string": "Tb2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.716095 -1.921772 0.000000\n7.716095 1.921772 0.000000\n-1.452867 0.000000 9.425702\nDy Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.607343 0.607343 0.441291 Dy\n0.392657 0.392657 0.558709 Dy\n0.194034 0.194034 0.166855 Ho\n0.805966 0.805966 0.833145 Ho\n0.094611 0.094611 0.302536 N\n0.905389 0.905389 0.697464 N\n0.461636 0.461636 0.359584 O\n0.538364 0.538364 0.640416 O\n0.365617 0.365617 0.028178 S\n0.634383 0.634383 0.971822 S\n0.785430 0.785430 0.348791 Se\n0.214570 0.214570 0.651209 Se\n0.949833 0.949833 0.232360 Tb\n0.050167 0.050167 0.767640 Tb\n",
"nsites": 14,
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"elements": [
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"S",
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],
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"density": 7.45368990941399,
"density_atomic": 0.05008237403854775,
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"volume_molar": 12.024471434530716,
"formula_full": "Tb2 Dy2 Ho2 Se2 S2 N2 O2",
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"formula_anonymous": "ABCDEFG",
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"spacegroup": 12
},
{
"id": "oqmd-1558144",
"created_at": "2022-09-04T15:55:41.452249Z",
"updated_at": "2022-09-04T15:55:41.452267Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.683426 -1.961848 0.000000\n7.683426 1.961848 0.000000\n-1.467403 0.000000 9.689560\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.799925 0.799925 0.324036 Dy\n0.200075 0.200075 0.675964 Dy\n0.901034 0.901034 0.193273 N\n0.098966 0.098966 0.806727 N\n0.385249 0.385249 0.051579 Nd\n0.614751 0.614751 0.948421 Nd\n0.537600 0.537600 0.144213 O\n0.462400 0.462400 0.855787 O\n0.213037 0.213037 0.160075 S\n0.786963 0.786963 0.839925 S\n0.630195 0.630195 0.475316 Se\n0.369805 0.369805 0.524684 Se\n0.046601 0.046601 0.262530 Tb\n0.953399 0.953399 0.737470 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Nd",
"O",
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],
"chemical_system": "Dy-N-Nd-O-S-Se-Tb",
"density": 6.89759447397903,
"density_atomic": 0.047926279339329504,
"volume": 292.11531111932675,
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"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbNdDySeSNO",
"formula_anonymous": "ABCDEFG",
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"spacegroup": 12
},
{
"id": "oqmd-1557807",
"created_at": "2022-09-04T15:55:41.483872Z",
"updated_at": "2022-09-04T15:55:41.483902Z",
"structure_string": "Tb2 Dy2 Er2 Se2 S2 N2 O2\n1.0\n7.713199 -1.913693 0.000000\n7.713199 1.913693 0.000000\n-1.573142 0.000000 9.453546\nDy Er N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.808806 0.808806 0.336570 Dy\n0.191194 0.191194 0.663430 Dy\n0.052186 0.052186 0.263958 Er\n0.947814 0.947814 0.736042 Er\n0.908000 0.908000 0.201191 N\n0.092000 0.092000 0.798809 N\n0.540060 0.540060 0.140785 O\n0.459940 0.459940 0.859215 O\n0.632987 0.632987 0.465791 S\n0.367013 0.367013 0.534209 S\n0.215276 0.215276 0.152239 Se\n0.784724 0.784724 0.847761 Se\n0.392643 0.392643 0.059696 Tb\n0.607357 0.607357 0.940304 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"formula_full": "Tb2 Dy2 Er2 Se2 S2 N2 O2",
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"spacegroup": 12
},
{
"id": "oqmd-1558492",
"created_at": "2022-09-04T15:55:42.252643Z",
"updated_at": "2022-09-04T15:55:42.252669Z",
"structure_string": "Gd2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.578399 -1.941411 0.000000\n7.578399 1.941411 0.000000\n-1.262543 0.000000 9.512387\nDy Gd Ho N O S Se\n2 2 2 2 2 2 2\ndirect\n0.797352 0.797352 0.316969 Dy\n0.202648 0.202648 0.683031 Dy\n0.045828 0.045828 0.261789 Gd\n0.954172 0.954172 0.738211 Gd\n0.388941 0.388941 0.051728 Ho\n0.611059 0.611059 0.948272 Ho\n0.900113 0.900113 0.182192 N\n0.099887 0.099887 0.817808 N\n0.536699 0.536699 0.138165 O\n0.463301 0.463301 0.861835 O\n0.212746 0.212746 0.149521 S\n0.787254 0.787254 0.850479 S\n0.629147 0.629147 0.479671 Se\n0.370853 0.370853 0.520329 Se\n",
"nsites": 14,
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"elements": [
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"Ho",
"N",
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"S",
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],
"chemical_system": "Dy-Gd-Ho-N-O-S-Se",
"density": 7.4240128550368025,
"density_atomic": 0.05001653206644681,
"volume": 279.9074510284128,
"volume_molar": 12.040300499042207,
"formula_full": "Gd2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "GdDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
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"spacegroup": 12
},
{
"id": "oqmd-1557994",
"created_at": "2022-09-04T15:55:41.219897Z",
"updated_at": "2022-09-04T15:55:41.219920Z",
"structure_string": "Tb2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.716538 -1.919493 0.000000\n7.716538 1.919493 0.000000\n-1.495151 0.000000 9.426585\nDy Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.949756 0.949756 0.232903 Dy\n0.050244 0.050244 0.767097 Dy\n0.193272 0.193272 0.165481 Ho\n0.806728 0.806728 0.834519 Ho\n0.094099 0.094099 0.300416 N\n0.905901 0.905901 0.699584 N\n0.461542 0.461542 0.358649 O\n0.538458 0.538458 0.641351 O\n0.365912 0.365912 0.029667 S\n0.634088 0.634088 0.970333 S\n0.785401 0.785401 0.347175 Se\n0.214599 0.214599 0.652825 Se\n0.607762 0.607762 0.441335 Tb\n0.392238 0.392238 0.558665 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"density": 7.461412217479095,
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"formula_full": "Tb2 Dy2 Ho2 Se2 S2 N2 O2",
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"formation_energy": -2.368962973557469,
"spacegroup": 12
},
{
"id": "oqmd-1557669",
"created_at": "2022-09-04T15:55:39.692362Z",
"updated_at": "2022-09-04T15:55:39.692374Z",
"structure_string": "Tb2 Dy2 Er2 Se2 S2 N2 O2\n1.0\n7.551106 -1.932117 0.000000\n7.551106 1.932117 0.000000\n-1.442657 0.000000 9.526235\nDy Er N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.950075 0.950075 0.243429 Dy\n0.049925 0.049925 0.756571 Dy\n0.610364 0.610364 0.446827 Er\n0.389636 0.389636 0.553173 Er\n0.096682 0.096682 0.316228 N\n0.903318 0.903318 0.683772 N\n0.460988 0.460988 0.363841 O\n0.539012 0.539012 0.636159 O\n0.785667 0.785667 0.353046 S\n0.214333 0.214333 0.646954 S\n0.370961 0.370961 0.027105 Se\n0.629039 0.629039 0.972895 Se\n0.199394 0.199394 0.181225 Tb\n0.800606 0.800606 0.818775 Tb\n",
"nsites": 14,
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"elements": [
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"formula_full": "Tb2 Dy2 Er2 Se2 S2 N2 O2",
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},
{
"id": "oqmd-1557700",
"created_at": "2022-09-04T15:55:39.848869Z",
"updated_at": "2022-09-04T15:55:39.848903Z",
"structure_string": "Gd2 Y2 Er2 Se2 S2 N2 O2\n1.0\n7.717689 -1.926707 0.000000\n7.717689 1.926707 0.000000\n-1.498058 0.000000 9.458199\nEr Gd N O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.394461 0.394461 0.058921 Er\n0.605539 0.605539 0.941079 Er\n0.806806 0.806806 0.332902 Gd\n0.193194 0.193194 0.667098 Gd\n0.906864 0.906864 0.194463 N\n0.093136 0.093136 0.805537 N\n0.538977 0.538977 0.137431 O\n0.461023 0.461023 0.862569 O\n0.632429 0.632429 0.467314 S\n0.367571 0.367571 0.532686 S\n0.214631 0.214631 0.146036 Se\n0.785369 0.785369 0.853964 Se\n0.051712 0.051712 0.263625 Y\n0.948288 0.948288 0.736375 Y\n",
"nsites": 14,
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"elements": [
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"chemical_system": "Er-Gd-N-O-S-Se-Y",
"density": 6.546315262903098,
"density_atomic": 0.04977217777551406,
"volume": 281.2816441977639,
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"formula_full": "Gd2 Y2 Er2 Se2 S2 N2 O2",
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"spacegroup": 12
},
{
"id": "oqmd-1557783",
"created_at": "2022-09-04T15:55:41.399782Z",
"updated_at": "2022-09-04T15:55:41.399819Z",
"structure_string": "Tb2 Y2 Er2 Se2 S2 N2 O2\n1.0\n7.719038 -1.915823 0.000000\n7.719038 1.915823 0.000000\n-1.588977 0.000000 9.466134\nEr N O S Se Tb Y\n2 2 2 2 2 2 2\ndirect\n0.052410 0.052410 0.262349 Er\n0.947590 0.947590 0.737651 Er\n0.908303 0.908303 0.200036 N\n0.091697 0.091697 0.799964 N\n0.540395 0.540395 0.140093 O\n0.459605 0.459605 0.859907 O\n0.632242 0.632242 0.464886 S\n0.367758 0.367758 0.535114 S\n0.215371 0.215371 0.150446 Se\n0.784629 0.784629 0.849554 Se\n0.809051 0.809051 0.336538 Tb\n0.190949 0.190949 0.663462 Tb\n0.392808 0.392808 0.059665 Y\n0.607192 0.607192 0.940335 Y\n",
"nsites": 14,
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"elements": [
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},
{
"id": "oqmd-1557686",
"created_at": "2022-09-04T15:55:39.585926Z",
"updated_at": "2022-09-04T15:55:39.585942Z",
"structure_string": "Gd2 Dy2 Er2 Se2 S2 N2 O2\n1.0\n7.574833 -1.930835 0.000000\n7.574833 1.930835 0.000000\n-1.575243 0.000000 9.568819\nDy Er Gd N O S Se\n2 2 2 2 2 2 2\ndirect\n0.802016 0.802016 0.322759 Dy\n0.197984 0.197984 0.677241 Dy\n0.050497 0.050497 0.256470 Er\n0.949503 0.949503 0.743530 Er\n0.387685 0.387685 0.053597 Gd\n0.612315 0.612315 0.946403 Gd\n0.904380 0.904380 0.191345 N\n0.095620 0.095620 0.808655 N\n0.539880 0.539880 0.139291 O\n0.460120 0.460120 0.860709 O\n0.214467 0.214467 0.151988 S\n0.785533 0.785533 0.848012 S\n0.630121 0.630121 0.469717 Se\n0.369879 0.369879 0.530283 Se\n",
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"density": 7.451777975449224,
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"formula_full": "Gd2 Dy2 Er2 Se2 S2 N2 O2",
"formula_reduced": "GdDyErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.480458422057469,
"spacegroup": 12
},
{
"id": "oqmd-1557658",
"created_at": "2022-09-04T15:55:39.591619Z",
"updated_at": "2022-09-04T15:55:39.591638Z",
"structure_string": "Gd2 Dy2 Er2 Se2 S2 N2 O2\n1.0\n7.731086 -1.916608 0.000000\n7.731086 1.916608 0.000000\n-1.588505 0.000000 9.472710\nDy Er Gd N O S Se\n2 2 2 2 2 2 2\ndirect\n0.808919 0.808919 0.337340 Dy\n0.191081 0.191081 0.662660 Dy\n0.052065 0.052065 0.264228 Er\n0.947935 0.947935 0.735772 Er\n0.392095 0.392095 0.059644 Gd\n0.607905 0.607905 0.940356 Gd\n0.908076 0.908076 0.202692 N\n0.091924 0.091924 0.797308 N\n0.540030 0.540030 0.141429 O\n0.459970 0.459970 0.858571 O\n0.633171 0.633171 0.465556 S\n0.366829 0.366829 0.534444 S\n0.215292 0.215292 0.153556 Se\n0.784708 0.784708 0.846444 Se\n",
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"formula_full": "Gd2 Dy2 Er2 Se2 S2 N2 O2",
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"formula_anonymous": "ABCDEFG",
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},
{
"id": "oqmd-1558229",
"created_at": "2022-09-04T15:55:39.734092Z",
"updated_at": "2022-09-04T15:55:39.734110Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.651757 -1.978403 0.000000\n7.651757 1.978403 0.000000\n-0.836081 0.000000 9.569984\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.613757 0.613757 0.452817 Gd\n0.386243 0.386243 0.547183 Gd\n0.107687 0.107687 0.323658 N\n0.892313 0.892313 0.676342 N\n0.964510 0.964510 0.227064 Nd\n0.035490 0.035490 0.772936 Nd\n0.468501 0.468501 0.356823 O\n0.531499 0.531499 0.643177 O\n0.792000 0.792000 0.344794 S\n0.208000 0.208000 0.655206 S\n0.373849 0.373849 0.005114 Se\n0.626151 0.626151 0.994886 Se\n0.210554 0.210554 0.184632 Tb\n0.789446 0.789446 0.815368 Tb\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
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"volume_molar": 12.463499639597822,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
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"spacegroup": 12
}
]
}