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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=1162",
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"results": [
{
"id": "jvasp-33799",
"created_at": "2022-09-04T14:38:07.426950Z",
"updated_at": "2022-09-04T14:38:07.426975Z",
"structure_string": "Se2 Br4\n1.0\n7.588379 0.000000 0.000000\n-0.000000 7.588379 0.000000\n0.000000 0.000000 3.660556\nSe Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Se\n0.499999 0.499999 0.500003 Se\n0.322965 0.322965 0.000000 Br\n0.677035 0.677035 0.000000 Br\n0.822964 0.177035 0.500003 Br\n0.177035 0.822964 0.500003 Br\n",
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{
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"created_at": "2022-09-04T14:36:00.378651Z",
"updated_at": "2022-09-04T14:36:00.378683Z",
"structure_string": "Se8 Br8\n1.0\n4.855045 0.106619 0.000000\n-0.738408 7.388688 0.000000\n0.000000 0.000000 14.091743\nSe Br\n8 8\ndirect\n0.100704 0.381355 0.136444 Se\n0.399295 0.618646 0.636444 Se\n0.899295 0.618646 0.863556 Se\n0.600704 0.381355 0.363556 Se\n0.828392 0.206222 0.038018 Se\n0.671606 0.793779 0.538018 Se\n0.171606 0.793779 0.961981 Se\n0.328393 0.206222 0.461982 Se\n0.863670 0.663523 0.145527 Br\n0.636328 0.336478 0.645527 Br\n0.136329 0.336478 0.854473 Br\n0.363670 0.663523 0.354473 Br\n0.493124 0.042985 0.147149 Br\n0.006875 0.957016 0.647149 Br\n0.506875 0.957016 0.852851 Br\n0.993123 0.042985 0.352851 Br\n",
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"formula_full": "Se8 Br8",
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{
"id": "jvasp-22664",
"created_at": "2022-09-04T14:37:07.989677Z",
"updated_at": "2022-09-04T14:37:07.989699Z",
"structure_string": "Se4 Br4\n1.0\n4.075323 -0.077307 -0.000000\n-1.031978 3.943253 -0.000000\n0.000000 0.000000 14.938059\nSe Br\n4 4\ndirect\n0.686847 0.955995 0.550403 Se\n0.455996 0.186848 0.050403 Se\n0.186848 0.455996 0.949597 Se\n0.955995 0.686847 0.449597 Se\n0.932842 0.049511 0.831035 Br\n0.432842 0.549511 0.668965 Br\n0.049511 0.932842 0.168965 Br\n0.549511 0.432842 0.331035 Br\n",
"nsites": 8,
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"elements": [
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"chemical_system": "Br-Se",
"density": 4.417587330472617,
"density_atomic": 0.03349195882376409,
"volume": 238.8633057294825,
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"formula_full": "Se4 Br4",
"formula_reduced": "SeBr",
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"spacegroup": 41
},
{
"id": "jvasp-123705",
"created_at": "2022-09-04T14:38:54.929742Z",
"updated_at": "2022-09-04T14:38:54.929758Z",
"structure_string": "Se2 S1\n1.0\n1.981158 -3.665717 0.038563\n2.184027 3.782843 0.000000\n0.046135 -0.026636 4.935589\nSe S\n2 1\ndirect\n0.758161 0.772334 0.493257 Se\n0.241840 0.014173 0.840075 Se\n0.000000 0.213491 0.166667 S\n",
"nsites": 3,
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"elements": [
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"S"
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"density": 4.124169363466473,
"density_atomic": 0.03921835160690203,
"volume": 76.49480095619396,
"volume_molar": 15.355415292212754,
"formula_full": "Se2 S1",
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"spacegroup": 5
},
{
"id": "jvasp-123688",
"created_at": "2022-09-04T14:38:52.745697Z",
"updated_at": "2022-09-04T14:38:52.745721Z",
"structure_string": "Se2 O1\n1.0\n1.838572 -3.402694 0.029554\n2.027535 3.511792 0.000000\n0.034759 -0.020068 4.408377\nSe O\n2 1\ndirect\n0.746207 0.783059 0.473363 Se\n0.253792 0.036852 0.859971 Se\n-0.000000 0.180087 0.166667 O\n",
"nsites": 3,
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"elements": [
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"chemical_system": "O-Se",
"density": 4.905521187703391,
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"volume": 58.87243110142166,
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"spacegroup": 5
},
{
"id": "jvasp-31902",
"created_at": "2022-09-04T14:38:35.321128Z",
"updated_at": "2022-09-04T14:38:35.321153Z",
"structure_string": "Se8 N4 Cl12\n1.0\n7.672351 0.000000 -0.420417\n0.000000 8.744914 0.000000\n0.003891 0.000000 8.965000\nSe N Cl\n8 4 12\ndirect\n0.402385 0.531678 0.720181 Se\n0.097615 0.031678 0.279819 Se\n0.542477 0.115341 0.678234 Se\n0.957523 0.615340 0.321765 Se\n0.042477 0.384659 0.678234 Se\n0.597614 0.468321 0.279819 Se\n0.457523 0.884659 0.321766 Se\n0.902385 0.968321 0.720181 Se\n0.307281 0.000682 0.219140 N\n0.692718 -0.000682 0.780859 N\n0.192718 0.500682 0.780859 N\n0.807281 0.499318 0.219140 N\n0.793523 0.161930 0.484811 Cl\n0.206476 0.838070 0.515188 Cl\n0.171675 0.589315 0.160426 Cl\n0.510033 0.309530 0.097943 Cl\n0.328324 0.089316 0.839574 Cl\n0.828324 0.410684 0.839574 Cl\n0.010033 0.190470 0.097944 Cl\n0.671675 0.910684 0.160425 Cl\n0.706476 0.661929 0.515188 Cl\n0.989966 0.809529 0.902056 Cl\n0.489966 0.690470 0.902056 Cl\n0.293524 0.338070 0.484812 Cl\n",
"nsites": 24,
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"elements": [
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"density": 3.072948986296705,
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"volume": 601.5124606191686,
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"formula_full": "Se8 N4 Cl12",
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"formula_anonymous": "AB2C3",
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"spacegroup": 14
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{
"id": "jvasp-123671",
"created_at": "2022-09-04T14:38:55.156264Z",
"updated_at": "2022-09-04T14:38:55.156292Z",
"structure_string": "Se2 I1\n1.0\n1.877895 -3.684494 0.060882\n2.251920 3.900437 0.000000\n0.128752 -0.074335 5.766056\nSe I\n2 1\ndirect\n0.735762 0.701204 0.551050 Se\n0.264234 -0.034560 0.782284 Se\n-0.000000 0.333356 0.166667 I\n",
"nsites": 3,
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"elements": [
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"I"
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"formula_full": "Se2 I1",
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"spacegroup": 12
},
{
"id": "jvasp-123661",
"created_at": "2022-09-04T14:38:55.167077Z",
"updated_at": "2022-09-04T14:38:55.167094Z",
"structure_string": "Se2 F1\n1.0\n1.857021 -3.390168 -0.116922\n2.007462 3.477025 -0.000000\n-0.166573 0.096171 4.280994\nSe F\n2 1\ndirect\n0.694487 0.680562 0.514161 Se\n0.305513 -0.013926 0.819172 Se\n-0.000000 0.333364 0.166667 F\n",
"nsites": 3,
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"elements": [
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"density": 5.182531191261093,
"density_atomic": 0.05292258765590692,
"volume": 56.68657057182194,
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"formula_full": "Se2 F1",
"formula_reduced": "Se2F",
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"spacegroup": 12
},
{
"id": "jvasp-17901",
"created_at": "2022-09-04T14:36:53.109047Z",
"updated_at": "2022-09-04T14:36:53.109072Z",
"structure_string": "Se2 Cl2 O5\n1.0\n3.639838 -0.000000 -0.588558\n-0.095169 3.638594 -0.588558\n-0.152333 -0.156369 10.607190\nSe Cl O\n2 2 5\ndirect\n0.087565 0.087565 0.175128 Se\n0.912436 0.912434 0.824871 Se\n0.208011 0.208011 0.416021 Cl\n0.791989 0.791988 0.583978 Cl\n0.399965 0.899964 0.799928 O\n0.899966 0.399964 0.799928 O\n0.600036 0.100035 0.200071 O\n0.100035 0.600035 0.200071 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 9,
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"formula_full": "Se2 Cl2 O5",
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"formula_anonymous": "A2B2C5",
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"spacegroup": 139
},
{
"id": "jvasp-30641",
"created_at": "2022-09-04T14:37:29.391347Z",
"updated_at": "2022-09-04T14:37:29.391365Z",
"structure_string": "Se2 Cl2 O5\n1.0\n3.639838 -0.000000 -0.588558\n-0.095169 3.638593 -0.588558\n-0.152318 -0.156354 10.607281\nSe Cl O\n2 2 5\ndirect\n0.087564 0.087564 0.175127 Se\n0.912436 0.912436 0.824873 Se\n0.208006 0.208007 0.416012 Cl\n0.791993 0.791993 0.583987 Cl\n0.399966 0.899967 0.799932 O\n0.899967 0.399967 0.799932 O\n0.600034 0.100033 0.200068 O\n0.100033 0.600033 0.200067 O\n0.000000 0.000000 0.000000 O\n",
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},
{
"id": "jvasp-123653",
"created_at": "2022-09-04T14:38:52.465480Z",
"updated_at": "2022-09-04T14:38:52.465506Z",
"structure_string": "Se2 Cl1\n1.0\n1.899876 -3.501769 -0.076548\n2.082684 3.607313 -0.000000\n-0.069966 0.040395 5.253621\nSe Cl\n2 1\ndirect\n0.713904 0.690273 0.541355 Se\n0.286096 -0.023630 0.791977 Se\n-0.000000 0.333354 0.166667 Cl\n",
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"formula_full": "Se2 Cl1",
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"spacegroup": 12
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{
"id": "jvasp-123648",
"created_at": "2022-09-04T14:38:52.411148Z",
"updated_at": "2022-09-04T14:38:52.411167Z",
"structure_string": "Se2 Br1\n1.0\n1.917583 -3.553065 -0.046657\n2.118254 3.668922 -0.000000\n-0.034758 0.020068 5.510294\nSe Br\n2 1\ndirect\n0.719751 0.693208 0.546595 Se\n0.280246 -0.026544 0.786736 Se\n-0.000000 0.333334 0.166667 Br\n",
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}