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{
"id": "jvasp-15406",
"created_at": "2022-09-04T14:36:42.661702Z",
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"structure_string": "Ho1 Cu2 Ge2\n1.0\n3.795404 0.000000 -1.378512\n-0.500683 3.762234 -1.378512\n-0.000308 -0.000351 5.913281\nHo Cu Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.250000 0.749999 0.500000 Cu\n0.749999 0.250000 0.500000 Cu\n0.618473 0.618473 0.236948 Ge\n0.381526 0.381526 0.763052 Ge\n",
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{
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"structure_string": "Ca1 Mg2 Sb2\n1.0\n2.331295 -4.037921 0.000000\n2.331295 4.037921 0.000000\n0.000000 0.000000 7.541484\nCa Mg Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333334 0.368473 Mg\n0.333334 0.666668 0.631527 Mg\n0.333334 0.666668 0.243201 Sb\n0.666668 0.333334 0.756799 Sb\n",
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{
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"structure_string": "Tb1 Si2 Cu2\n1.0\n3.755838 0.000000 -1.392952\n-0.516613 3.720138 -1.392952\n-0.007019 -0.008062 5.741011\nTb Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.618164 0.618164 0.236327 Si\n0.381837 0.381838 0.763674 Si\n0.250001 0.750001 0.500001 Cu\n0.750001 0.250000 0.500001 Cu\n",
"nsites": 5,
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"elements": [
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"formula_full": "Tb1 Si2 Cu2",
"formula_reduced": "Tb(CuSi)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-15713",
"created_at": "2022-09-04T14:36:40.305842Z",
"updated_at": "2022-09-04T14:36:40.305866Z",
"structure_string": "Sc1 Si2 Cu2\n1.0\n3.616741 -0.000000 -1.277526\n-0.451255 3.588479 -1.277526\n-0.003275 -0.003712 5.749081\nSc Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.612864 0.612866 0.225731 Si\n0.387133 0.387135 0.774267 Si\n0.749999 0.250000 0.499999 Cu\n0.249998 0.750000 0.499999 Cu\n",
"nsites": 5,
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"volume": 74.58071266336431,
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"formula_full": "Sc1 Si2 Cu2",
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"spacegroup": 139
},
{
"id": "jvasp-15417",
"created_at": "2022-09-04T14:36:51.779351Z",
"updated_at": "2022-09-04T14:36:51.779372Z",
"structure_string": "Th1 Si2 Pt2\n1.0\n3.994630 -0.000000 -1.593082\n-0.635331 3.943783 -1.593082\n0.006375 0.007484 5.820764\nTh Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.620583 0.620583 0.241167 Si\n0.379416 0.379416 0.758832 Si\n0.749999 0.249999 0.500000 Pt\n0.249999 0.749999 0.500000 Pt\n",
"nsites": 5,
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"volume": 91.79530158200538,
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"formula_full": "Th1 Si2 Pt2",
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},
{
"id": "jvasp-8335",
"created_at": "2022-09-04T14:36:47.229992Z",
"updated_at": "2022-09-04T14:36:47.230012Z",
"structure_string": "Zn1 Cr2 N2\n1.0\n3.673761 0.000000 0.000000\n0.000000 3.673798 0.000000\n0.000000 0.000000 5.343783\nZn Cr N\n1 2 2\ndirect\n0.000000 0.000000 0.249989 Zn\n0.500000 0.500000 0.000578 Cr\n0.500000 0.500000 0.499414 Cr\n0.500000 0.000000 0.483617 N\n0.000000 0.500000 0.016401 N\n",
"nsites": 5,
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"formula_full": "Zn1 Cr2 N2",
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},
{
"id": "jvasp-2253",
"created_at": "2022-09-04T14:36:55.361285Z",
"updated_at": "2022-09-04T14:36:55.361308Z",
"structure_string": "Tm2 S1 O2\n1.0\n1.863989 -3.228523 0.000000\n1.863989 3.228523 0.000000\n0.000000 0.000000 6.509587\nTm S O\n2 1 2\ndirect\n0.333334 0.666667 0.282968 Tm\n0.666667 0.333334 0.717032 Tm\n0.000000 0.000000 0.000000 S\n0.333334 0.666667 0.629402 O\n0.666667 0.333334 0.370598 O\n",
"nsites": 5,
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"volume": 78.34849547307402,
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"formula_full": "Tm2 S1 O2",
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"spacegroup": 164
},
{
"id": "jvasp-8295",
"created_at": "2022-09-04T14:36:45.728186Z",
"updated_at": "2022-09-04T14:36:45.728207Z",
"structure_string": "Ca1 W2 N2\n1.0\n3.360426 0.000000 0.000000\n0.000000 3.360995 0.000000\n0.000000 0.000000 7.641936\nCa W N\n1 2 2\ndirect\n0.000000 0.000000 0.249998 Ca\n0.500001 0.499999 0.916962 W\n0.500001 0.499999 0.583014 W\n0.500001 0.000000 0.460675 N\n0.000000 0.499999 0.039352 N\n",
"nsites": 5,
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"formula_full": "Ca1 W2 N2",
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"spacegroup": 115
},
{
"id": "jvasp-8298",
"created_at": "2022-09-04T14:36:47.207946Z",
"updated_at": "2022-09-04T14:36:47.207962Z",
"structure_string": "Zn1 Ni2 N2\n1.0\n3.501380 0.000000 0.000000\n0.000000 3.501380 -0.000000\n0.000000 -0.000000 5.035404\nZn Ni N\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.267498 Ni\n0.500000 0.500000 0.732502 Ni\n0.500000 0.000000 0.758699 N\n0.000000 0.500000 0.241300 N\n",
"nsites": 5,
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"density": 5.670558610539896,
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"formula_full": "Zn1 Ni2 N2",
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},
{
"id": "jvasp-56824",
"created_at": "2022-09-04T14:36:45.295230Z",
"updated_at": "2022-09-04T14:36:45.295254Z",
"structure_string": "Ho1 Si2 Ir2\n1.0\n3.818700 -0.000000 -1.467931\n-0.564282 3.776778 -1.467931\n0.016661 0.019335 5.744321\nHo Si Ir\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.379291 0.379292 0.758583 Si\n0.620710 0.620710 0.241418 Si\n0.750000 0.250001 0.500000 Ir\n0.250000 0.750001 0.500000 Ir\n",
"nsites": 5,
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"spacegroup": 139
},
{
"id": "jvasp-15091",
"created_at": "2022-09-04T14:36:40.198924Z",
"updated_at": "2022-09-04T14:36:40.198960Z",
"structure_string": "Nd1 Si2 Cu2\n1.0\n3.836282 0.000000 -1.453573\n-0.550761 3.796540 -1.453573\n-0.005830 -0.006736 5.773774\nNd Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.620937 0.620937 0.241875 Si\n0.379062 0.379062 0.758125 Si\n0.750000 0.249999 0.500000 Cu\n0.250000 0.749999 0.500000 Cu\n",
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},
{
"id": "jvasp-11529",
"created_at": "2022-09-04T14:36:45.261853Z",
"updated_at": "2022-09-04T14:36:45.261887Z",
"structure_string": "Mg4 Sn2 N4\n1.0\n4.073079 -0.003074 0.003305\n-2.032369 5.294188 -0.119999\n-0.007085 -2.249955 6.657423\nMg Sn N\n4 2 4\ndirect\n0.320835 0.666826 0.478329 Mg\n0.654399 0.333931 0.520121 Mg\n0.980886 0.982464 0.295911 Mg\n0.998765 0.018276 0.702553 Mg\n0.725433 0.338965 0.078355 Sn\n0.386847 0.661751 0.920095 Sn\n0.820852 0.669334 0.411984 N\n0.151875 0.331411 0.586473 N\n0.468213 0.967361 0.779465 N\n0.501256 0.033363 0.218999 N\n",
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"formula_full": "Mg4 Sn2 N4",
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