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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom&page=12101",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom&page=12099",
"results": [
{
"id": "mp-1185073",
"created_at": "2022-09-04T14:42:53.331159Z",
"structure_string": "K3 Tb1\n1.0\n0.000000 4.862582 4.862582\n4.862582 0.000000 4.862582\n4.862582 4.862582 0.000000\nK Tb\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Tb\n",
"nsites": 4,
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"elements": [
"K",
"Tb"
],
"chemical_system": "K-Tb",
"density": 1.9946826102249435,
"density_atomic": 0.017395190185295978,
"volume": 229.94862127929878,
"volume_molar": 34.61957412279671,
"formula_full": "K3 Tb1",
"formula_reduced": "K3Tb",
"formula_anonymous": "AB3",
"energy": -5.58363942,
"energy_per_atom": -1.395909855,
"energy_above_hull": null,
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"energy_uncorrected": -5.58363942,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:56.100000Z",
"spacegroup": 225
},
{
"id": "mp-1184900",
"created_at": "2022-09-04T14:39:19.919401Z",
"structure_string": "K3 Dy1\n1.0\n-2.912462 2.912462 6.644916\n2.912462 -2.912462 6.644916\n2.912462 2.912462 -6.644916\nK Dy\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Dy"
],
"chemical_system": "Dy-K",
"density": 2.060719447139384,
"density_atomic": 0.01774148504040833,
"volume": 225.46026958225465,
"volume_molar": 33.9438369802971,
"formula_full": "K3 Dy1",
"formula_reduced": "K3Dy",
"formula_anonymous": "AB3",
"energy": -5.58359638,
"energy_per_atom": -1.395899095,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -5.58359638,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4174315,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:37.292000Z",
"spacegroup": 139
},
{
"id": "mp-1097227",
"created_at": "2022-09-04T14:45:39.832408Z",
"structure_string": "Sr2 Hg1 Sb1\n1.0\n-6.397372 6.442477 9.398187\n6.397372 -6.442477 9.398187\n6.397372 6.442477 -9.398187\nSr Hg Sb\n2 1 1\ndirect\n0.771167 0.000000 0.771167 Sr\n0.228833 0.000000 0.228833 Sr\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Hg",
"Sb"
],
"chemical_system": "Hg-Sb-Sr",
"density": 0.5332884598962254,
"density_atomic": 0.0025816742075110218,
"volume": 1549.3821754745647,
"volume_molar": 233.26493879357122,
"formula_full": "Sr2 Hg1 Sb1",
"formula_reduced": "Sr2HgSb",
"formula_anonymous": "ABC2",
"energy": -5.58297361,
"energy_per_atom": -1.3957434025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -5.39097361,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0043102,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:16.991000Z",
"spacegroup": 71
},
{
"id": "mp-1183646",
"created_at": "2022-09-04T14:40:51.417407Z",
"structure_string": "Cd3 Ga1\n1.0\n-2.178548 2.178548 4.700252\n2.178548 -2.178548 4.700252\n2.178548 2.178548 -4.700252\nCd Ga\n3 1\ndirect\n0.750000 0.250000 0.500000 Cd\n0.250000 0.750000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Ga"
],
"chemical_system": "Cd-Ga",
"density": 7.5732301077594135,
"density_atomic": 0.04482750737923312,
"volume": 89.23092614007462,
"volume_molar": 13.434029934017321,
"formula_full": "Cd3 Ga1",
"formula_reduced": "Cd3Ga",
"formula_anonymous": "AB3",
"energy": -5.58214843,
"energy_per_atom": -1.3955371075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.58214843,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0022961,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.202000Z",
"spacegroup": 139
},
{
"id": "mp-1026620",
"created_at": "2022-09-04T14:45:05.833391Z",
"structure_string": "Rb1 Mg14 Cd1\n1.0\n6.602644 -0.000000 -0.000000\n-3.301322 5.718057 -0.000000\n0.000000 -0.000000 10.672756\nRb Mg Cd\n1 14 1\ndirect\n0.166667 0.333333 0.125000 Rb\n0.175655 0.837827 0.125000 Mg\n0.161944 0.830972 0.625000 Mg\n0.662173 0.324345 0.125000 Mg\n0.669028 0.338056 0.625000 Mg\n0.662173 0.837827 0.125000 Mg\n0.669028 0.830972 0.625000 Mg\n0.340483 0.159517 0.394921 Mg\n0.340483 0.159517 0.855079 Mg\n0.340483 0.680967 0.394921 Mg\n0.340483 0.680967 0.855079 Mg\n0.819033 0.159517 0.394921 Mg\n0.819033 0.159517 0.855079 Mg\n0.833333 0.666667 0.369714 Mg\n0.833333 0.666667 0.880286 Mg\n0.166667 0.333333 0.625000 Cd\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Cd"
],
"chemical_system": "Cd-Mg-Rb",
"density": 2.217729283003707,
"density_atomic": 0.03970791101476044,
"volume": 402.9423757410052,
"volume_molar": 15.166098155507141,
"formula_full": "Rb1 Mg14 Cd1",
"formula_reduced": "RbMg14Cd",
"formula_anonymous": "ABC14",
"energy": -22.30048699,
"energy_per_atom": -1.393780436875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -22.30048699,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.41e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:50.766000Z",
"spacegroup": 187
},
{
"id": "mp-680394",
"created_at": "2022-09-04T14:39:29.143781Z",
"structure_string": "Ca24 Al8 Cd136\n1.0\n11.199472 -11.208200 0.000000\n11.199472 11.208200 0.000000\n-0.017464 0.000000 15.844609\nCa Al Cd\n24 8 136\ndirect\n0.198836 0.497885 0.310660 Ca\n0.801021 0.501172 0.313979 Ca\n0.501112 0.689599 0.201713 Ca\n0.689599 0.201713 0.501112 Ca\n0.803569 0.502102 0.690603 Ca\n0.502102 0.690603 0.803569 Ca\n0.187703 0.298805 0.998701 Ca\n0.699168 0.001072 0.190219 Ca\n0.998701 0.187703 0.298805 Ca\n0.298805 0.998701 0.187703 Ca\n0.310660 0.198836 0.497885 Ca\n0.698995 0.002394 0.811665 Ca\n0.809270 0.304688 0.000800 Ca\n0.190219 0.699168 0.001072 Ca\n0.304688 0.000800 0.809270 Ca\n0.002394 0.811665 0.698995 Ca\n0.690603 0.803569 0.502102 Ca\n0.313979 0.801021 0.501172 Ca\n0.000800 0.809270 0.304688 Ca\n0.001072 0.190219 0.699168 Ca\n0.497885 0.310660 0.198836 Ca\n0.501172 0.313979 0.801021 Ca\n0.201713 0.501112 0.689599 Ca\n0.811665 0.698995 0.002394 Ca\n0.068124 0.075357 0.947594 Al\n0.075357 0.947594 0.068124 Al\n0.582144 0.432992 0.494294 Al\n0.424765 0.424765 0.424765 Al\n0.432992 0.494294 0.582144 Al\n0.494294 0.582144 0.432992 Al\n0.947594 0.068124 0.075357 Al\n0.945566 0.945566 0.945566 Al\n0.001724 0.772796 0.909661 Cd\n0.697878 0.386838 0.837564 Cd\n0.831203 0.169154 0.168629 Cd\n0.999282 0.405515 0.342812 Cd\n0.169154 0.168629 0.831203 Cd\n0.697043 0.616982 0.164134 Cd\n0.300141 0.385183 0.152627 Cd\n0.656278 0.660261 0.345602 Cd\n0.504916 0.720336 0.588411 Cd\n0.387889 0.160689 0.694779 Cd\n0.501970 0.904398 0.158073 Cd\n0.597557 0.657870 0.002603 Cd\n0.094072 0.156294 0.499367 Cd\n0.345602 0.656278 0.660261 Cd\n0.694779 0.387889 0.160689 Cd\n0.500561 0.997925 0.315915 Cd\n0.595610 0.344845 0.999111 Cd\n0.236570 0.905614 0.998823 Cd\n0.500840 0.263085 0.404350 Cd\n0.905614 0.998823 0.236570 Cd\n0.405515 0.342812 0.999282 Cd\n0.500589 0.100062 0.505965 Cd\n0.998823 0.236570 0.905614 Cd\n0.838729 0.162826 0.839622 Cd\n0.655885 0.000522 0.406559 Cd\n0.280588 0.589290 0.498914 Cd\n0.660170 0.201452 0.883496 Cd\n0.116384 0.344832 0.800332 Cd\n0.501757 0.904925 0.844467 Cd\n0.904398 0.158073 0.501970 Cd\n0.002603 0.597557 0.657870 Cd\n0.688380 0.501467 0.999410 Cd\n0.837574 0.837574 0.837574 Cd\n0.883496 0.660170 0.201452 Cd\n0.616982 0.164134 0.697043 Cd\n0.117621 0.340073 0.198778 Cd\n0.665485 0.665485 0.665485 Cd\n0.301126 0.616449 0.158085 Cd\n0.999882 0.501406 0.185603 Cd\n0.904925 0.844467 0.501757 Cd\n0.000642 0.598600 0.999059 Cd\n0.315915 0.500561 0.997925 Cd\n0.298688 0.379995 0.843302 Cd\n0.198778 0.117621 0.340073 Cd\n0.340911 0.663080 0.338308 Cd\n0.802389 0.883766 0.343272 Cd\n0.156294 0.499367 0.094072 Cd\n0.404350 0.500840 0.263085 Cd\n0.660520 0.802529 0.115535 Cd\n0.346033 0.199718 0.880126 Cd\n0.097281 0.842233 0.502803 Cd\n0.800332 0.116384 0.344832 Cd\n0.656363 0.201118 0.116469 Cd\n0.999410 0.688380 0.501467 Cd\n0.660375 0.803117 0.885779 Cd\n0.201118 0.116469 0.656363 Cd\n0.885779 0.660375 0.803117 Cd\n0.094326 0.001847 0.770830 Cd\n0.844467 0.501757 0.904925 Cd\n0.841417 0.298423 0.623983 Cd\n0.997373 0.241941 0.092225 Cd\n0.406559 0.655885 0.000522 Cd\n0.842233 0.502803 0.097281 Cd\n0.510855 0.501789 0.908634 Cd\n0.324129 0.324129 0.324129 Cd\n0.340073 0.198778 0.117621 Cd\n0.344845 0.999111 0.595610 Cd\n0.908634 0.510855 0.501789 Cd\n0.663080 0.338308 0.340911 Cd\n0.162826 0.839622 0.838729 Cd\n0.342812 0.999282 0.405515 Cd\n0.501406 0.185603 0.999882 Cd\n0.154760 0.154760 0.154760 Cd\n0.617460 0.842141 0.699270 Cd\n0.100062 0.505965 0.500589 Cd\n0.720336 0.588411 0.504916 Cd\n0.505965 0.500589 0.100062 Cd\n0.589290 0.498914 0.280588 Cd\n0.407600 0.995463 0.999879 Cd\n0.699270 0.617460 0.842141 Cd\n0.168629 0.831203 0.169154 Cd\n0.623983 0.841417 0.298423 Cd\n0.241941 0.092225 0.997373 Cd\n0.263085 0.404350 0.500840 Cd\n0.842141 0.699270 0.617460 Cd\n0.498914 0.280588 0.589290 Cd\n0.501789 0.908634 0.510855 Cd\n0.160689 0.694779 0.387889 Cd\n0.385183 0.152627 0.300141 Cd\n0.999059 0.000642 0.598600 Cd\n0.501467 0.999410 0.688380 Cd\n0.116469 0.656363 0.201118 Cd\n0.997925 0.315915 0.500561 Cd\n0.772796 0.909661 0.001724 Cd\n0.770830 0.094326 0.001847 Cd\n0.501198 0.813493 0.000797 Cd\n0.201452 0.883496 0.660170 Cd\n0.995463 0.999879 0.407600 Cd\n0.158085 0.301126 0.616449 Cd\n0.338308 0.340911 0.663080 Cd\n0.616449 0.158085 0.301126 Cd\n0.158073 0.501970 0.904398 Cd\n0.000522 0.406559 0.655885 Cd\n0.802529 0.115535 0.660520 Cd\n0.164134 0.697043 0.616982 Cd\n0.000797 0.501198 0.813493 Cd\n0.660261 0.345602 0.656278 Cd\n0.115535 0.660520 0.802529 Cd\n0.909661 0.001724 0.772796 Cd\n0.001847 0.770830 0.094326 Cd\n0.199718 0.880126 0.346033 Cd\n0.839622 0.838729 0.162826 Cd\n0.298423 0.623983 0.841417 Cd\n0.598600 0.999059 0.000642 Cd\n0.499367 0.094072 0.156294 Cd\n0.152627 0.300141 0.385183 Cd\n0.999879 0.407600 0.995463 Cd\n0.883766 0.343272 0.802389 Cd\n0.343272 0.802389 0.883766 Cd\n0.344832 0.800332 0.116384 Cd\n0.657870 0.002603 0.597557 Cd\n0.405805 0.501829 0.754660 Cd\n0.092225 0.997373 0.241941 Cd\n0.999111 0.595610 0.344845 Cd\n0.803117 0.885779 0.660375 Cd\n0.837564 0.697878 0.386838 Cd\n0.754660 0.405805 0.501829 Cd\n0.379995 0.843302 0.298688 Cd\n0.501829 0.754660 0.405805 Cd\n0.588411 0.504916 0.720336 Cd\n0.843302 0.298688 0.379995 Cd\n0.813493 0.000797 0.501198 Cd\n0.386838 0.837564 0.697878 Cd\n0.185603 0.999882 0.501406 Cd\n0.502803 0.097281 0.842233 Cd\n0.880126 0.346033 0.199718 Cd\n",
"nsites": 168,
"nelements": 3,
"elements": [
"Ca",
"Al",
"Cd"
],
"chemical_system": "Al-Ca-Cd",
"density": 6.873568286349558,
"density_atomic": 0.04223420652823254,
"volume": 3977.818309139917,
"volume_molar": 14.258917723420105,
"formula_full": "Ca24 Al8 Cd136",
"formula_reduced": "Ca3AlCd17",
"formula_anonymous": "AB3C17",
"energy": -234.05223058,
"energy_per_atom": -1.3931680391666668,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -234.05223058,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0218951,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:29.646000Z",
"spacegroup": 146
},
{
"id": "mp-1094463",
"created_at": "2022-09-04T14:47:21.457517Z",
"structure_string": "Mg2 Zn4\n1.0\n2.486394 -4.306560 0.000000\n2.486394 4.306560 0.000000\n0.000000 0.000000 4.772897\nMg Zn\n2 4\ndirect\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666667 0.500000 Mg\n0.000000 0.319620 0.000000 Zn\n0.680380 0.680380 0.000000 Zn\n0.319620 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Zn"
],
"chemical_system": "Mg-Zn",
"density": 5.040142076515887,
"density_atomic": 0.05870008647138048,
"volume": 102.21450019371487,
"volume_molar": 10.259168464659972,
"formula_full": "Mg2 Zn4",
"formula_reduced": "MgZn2",
"formula_anonymous": "AB2",
"energy": -8.35288994,
"energy_per_atom": -1.3921483233333334,
"energy_above_hull": null,
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"energy_uncorrected": -8.35288994,
"band_gap": 0.0,
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"total_magnetization": 0.00193,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:03.853000Z",
"spacegroup": 189
},
{
"id": "mp-601148",
"created_at": "2022-09-04T14:43:09.869039Z",
"structure_string": "I1\n1.0\n-1.617456 1.617456 4.264808\n1.617456 -1.617456 4.264808\n1.617456 1.617456 -4.264808\nI\n1\ndirect\n0.000000 0.000000 0.000000 I\n",
"nsites": 1,
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"elements": [
"I"
],
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"density": 4.721734801160363,
"density_atomic": 0.022406580015506803,
"volume": 44.6297471237438,
"volume_molar": 26.876661926239027,
"formula_full": "I1",
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"energy": -1.3921211,
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"updated_at": "2021-11-28T01:36:00.155000Z",
"spacegroup": 139
},
{
"id": "mp-1096194",
"created_at": "2022-09-04T14:43:58.062247Z",
"structure_string": "Tl2 Hg1 Au1\n1.0\n-6.195126 6.199297 8.722559\n6.195126 -6.199297 8.722559\n6.195126 6.199297 -8.722559\nTl Hg Au\n2 1 1\ndirect\n0.772599 0.000000 0.772599 Tl\n0.227401 0.000000 0.227401 Tl\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
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"elements": [
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"Hg",
"Au"
],
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"density": 0.9992214363718285,
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"volume": 1339.974377742406,
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"formula_full": "Tl2 Hg1 Au1",
"formula_reduced": "Tl2HgAu",
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"energy": -5.56815722,
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"updated_at": "2021-11-28T01:36:09.879000Z",
"spacegroup": 71
},
{
"id": "mp-1201245",
"created_at": "2022-09-04T14:47:56.916700Z",
"structure_string": "Pr3 Cd33\n1.0\n9.468073 0.000000 0.000000\n0.000000 9.468073 0.000000\n0.000000 0.000000 9.468073\nPr Cd\n3 33\ndirect\n0.000000 0.000000 0.500000 Pr\n0.000000 0.500000 0.000000 Pr\n0.500000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Cd\n0.155447 0.155447 0.844553 Cd\n0.155447 0.844553 0.155447 Cd\n0.844553 0.155447 0.155447 Cd\n0.844553 0.844553 0.844553 Cd\n0.844553 0.844553 0.155447 Cd\n0.844553 0.155447 0.844553 Cd\n0.155447 0.844553 0.844553 Cd\n0.155447 0.155447 0.155447 Cd\n0.345474 0.345474 0.000000 Cd\n0.345474 0.000000 0.654526 Cd\n0.000000 0.345474 0.654526 Cd\n0.345474 0.654526 0.000000 Cd\n0.345474 0.000000 0.345474 Cd\n0.000000 0.654526 0.345474 Cd\n0.654526 0.345474 0.000000 Cd\n0.654526 0.000000 0.345474 Cd\n0.000000 0.345474 0.345474 Cd\n0.654526 0.654526 0.000000 Cd\n0.654526 0.000000 0.654526 Cd\n0.000000 0.654526 0.654526 Cd\n0.265484 0.265484 0.500000 Cd\n0.265484 0.500000 0.734516 Cd\n0.500000 0.265484 0.734516 Cd\n0.265484 0.734516 0.500000 Cd\n0.265484 0.500000 0.265484 Cd\n0.500000 0.734516 0.265484 Cd\n0.734516 0.265484 0.500000 Cd\n0.734516 0.500000 0.265484 Cd\n0.500000 0.265484 0.265484 Cd\n0.734516 0.734516 0.500000 Cd\n0.734516 0.500000 0.734516 Cd\n0.500000 0.734516 0.734516 Cd\n",
"nsites": 36,
"nelements": 2,
"elements": [
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],
"chemical_system": "Cd-Pr",
"density": 8.084528025610918,
"density_atomic": 0.04241482774317384,
"volume": 848.7597832056214,
"volume_molar": 14.198196905253711,
"formula_full": "Pr3 Cd33",
"formula_reduced": "PrCd11",
"formula_anonymous": "AB11",
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"energy_per_atom": -1.3913821244444444,
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"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -50.08975648,
"band_gap": 0.0,
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"total_magnetization": 0.0013039,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:17.440000Z",
"spacegroup": 221
},
{
"id": "mp-1184906",
"created_at": "2022-09-04T14:47:17.592524Z",
"structure_string": "K6 Er2\n1.0\n4.298095 -7.444519 0.000000\n4.298095 7.444519 0.000000\n0.000000 0.000000 7.061734\nK Er\n6 2\ndirect\n0.172299 0.344599 0.250000 K\n0.655401 0.827701 0.250000 K\n0.172299 0.827701 0.250000 K\n0.827701 0.655401 0.750000 K\n0.344599 0.172299 0.750000 K\n0.827701 0.172299 0.750000 K\n0.333333 0.666667 0.750000 Er\n0.666667 0.333333 0.250000 Er\n",
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"elements": [
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],
"chemical_system": "Er-K",
"density": 2.0911714069321423,
"density_atomic": 0.01770255627518665,
"volume": 451.91213492784965,
"volume_molar": 34.018481096095286,
"formula_full": "K6 Er2",
"formula_reduced": "K3Er",
"formula_anonymous": "AB3",
"energy": -11.12812274,
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"energy_above_hull": null,
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"formation_energy": null,
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"energy_uncorrected": -11.12812274,
"band_gap": 0.0,
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"is_magnetic": true,
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"updated_at": "2021-11-28T01:38:03.297000Z",
"spacegroup": 194
},
{
"id": "mp-1184884",
"created_at": "2022-09-04T14:47:32.414144Z",
"structure_string": "K3 Dy1\n1.0\n0.000000 4.856615 4.856615\n4.856615 0.000000 4.856615\n4.856615 4.856615 0.000000\nK Dy\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Dy\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Dy-K",
"density": 2.0279529052871688,
"density_atomic": 0.017459385935212828,
"volume": 229.10313196826877,
"volume_molar": 34.49228273174426,
"formula_full": "K3 Dy1",
"formula_reduced": "K3Dy",
"formula_anonymous": "AB3",
"energy": -5.55613968,
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"energy_uncorrected": -5.55613968,
"band_gap": 0.0,
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"total_magnetization": 0.361056,
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"updated_at": "2021-11-28T01:38:10.826000Z",
"spacegroup": 225
}
]
}