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{
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"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=elements&page=10128",
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"results": [
{
"id": "mp-1195343",
"created_at": "2022-09-04T14:41:18.476561Z",
"structure_string": "Pu4 Mo4 Br4 O20\n1.0\n0.000000 7.355008 0.000000\n0.016244 0.000000 7.383000\n11.447439 0.000000 -2.909590\nPu Mo Br O\n4 4 4 20\ndirect\n0.416964 0.613046 0.264359 Pu\n0.916964 0.886954 0.735641 Pu\n0.583036 0.386954 0.735641 Pu\n0.083036 0.113046 0.264359 Pu\n0.931398 0.695453 0.386374 Mo\n0.431398 0.804547 0.613626 Mo\n0.068602 0.304547 0.613626 Mo\n0.568602 0.195453 0.386374 Mo\n0.381631 0.885130 0.120062 Br\n0.881631 0.614870 0.879938 Br\n0.618369 0.114870 0.879938 Br\n0.118369 0.385130 0.120062 Br\n0.891091 0.819453 0.537882 O\n0.391091 0.680547 0.462118 O\n0.108909 0.180547 0.462118 O\n0.608909 0.319453 0.537882 O\n0.088307 0.823733 0.314634 O\n0.588307 0.676267 0.685366 O\n0.911693 0.176267 0.685366 O\n0.411693 0.323733 0.314634 O\n0.034824 0.480014 0.379025 O\n0.534824 0.019986 0.620975 O\n0.965176 0.519986 0.620975 O\n0.465176 0.980014 0.379025 O\n0.517861 0.493006 0.126879 O\n0.017861 0.006994 0.873121 O\n0.482139 0.506994 0.873121 O\n0.982139 0.993006 0.126879 O\n0.710806 0.658331 0.318297 O\n0.210806 0.841669 0.681703 O\n0.289194 0.341669 0.681703 O\n0.789194 0.158331 0.318297 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
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"Mo",
"Br",
"O"
],
"chemical_system": "Br-Mo-O-Pu",
"density": 5.337941512114138,
"density_atomic": 0.05144969726886348,
"volume": 621.9667305868849,
"volume_molar": 11.704909998847556,
"formula_full": "Pu4 Mo4 Br4 O20",
"formula_reduced": "PuMoBrO5",
"formula_anonymous": "ABCD5",
"energy": -277.12781412000004,
"energy_per_atom": -8.660244191250001,
"energy_above_hull": null,
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"energy_uncorrected": -248.44381412,
"band_gap": 0.0974999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.0000124,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:17.632000Z",
"spacegroup": 14
},
{
"id": "mp-1219882",
"created_at": "2022-09-04T14:39:32.825834Z",
"structure_string": "Pu2 P4 C2 O14\n1.0\n0.000000 -5.942574 0.000000\n-6.463684 0.000000 1.656866\n-0.257285 0.000000 -8.990205\nPu P C O\n2 4 2 14\ndirect\n0.255515 0.626480 0.288682 Pu\n0.755515 0.373520 0.711318 Pu\n0.757457 0.983925 0.327079 P\n0.257457 0.016075 0.672921 P\n0.755376 0.318481 0.099603 P\n0.255376 0.681519 0.900397 P\n0.762973 0.089151 0.164086 C\n0.262973 0.910849 0.835914 C\n0.542047 0.856588 0.316137 O\n0.042047 0.143412 0.683863 O\n0.466360 0.151201 0.677931 O\n0.966360 0.848799 0.322069 O\n0.752263 0.258084 0.923515 O\n0.252263 0.741916 0.076485 O\n0.252026 0.438977 0.408244 O\n0.752026 0.561023 0.591756 O\n0.973571 0.429969 0.159667 O\n0.473571 0.570031 0.840333 O\n0.037782 0.572422 0.837302 O\n0.537782 0.427578 0.162698 O\n0.760631 0.175441 0.455500 O\n0.260631 0.824559 0.544500 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Pu",
"P",
"C",
"O"
],
"chemical_system": "C-O-P-Pu",
"density": 4.104899215986418,
"density_atomic": 0.06324469004646253,
"volume": 347.85529004629103,
"volume_molar": 9.52197054895178,
"formula_full": "Pu2 P4 C2 O14",
"formula_reduced": "PuP2CO7",
"formula_anonymous": "ABC2D7",
"energy": -182.58764665,
"energy_per_atom": -8.29943848409091,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -172.96964665,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.0018866,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:38.034000Z",
"spacegroup": 4
},
{
"id": "mp-1197627",
"created_at": "2022-09-04T14:43:59.845397Z",
"structure_string": "Pu4 Te8 Cl4 O22\n1.0\n8.163839 0.000000 0.000000\n-1.263328 9.708876 0.000000\n-3.353506 -4.188619 9.190380\nPu Te Cl O\n4 8 4 22\ndirect\n0.381150 0.613577 0.619570 Pu\n0.618850 0.386423 0.380430 Pu\n0.124431 0.876265 0.880907 Pu\n0.875569 0.123735 0.119093 Pu\n0.997990 0.765693 0.494362 Te\n0.002010 0.234307 0.505638 Te\n0.200548 0.532093 0.237444 Te\n0.799452 0.467907 0.762556 Te\n0.743652 0.991066 0.708418 Te\n0.256348 0.008934 0.291582 Te\n0.532765 0.748039 0.053095 Te\n0.467235 0.251961 0.946905 Te\n0.903822 0.630473 0.127039 Cl\n0.096178 0.369527 0.872961 Cl\n0.639660 0.898830 0.391849 Cl\n0.360340 0.101170 0.608151 Cl\n0.692184 0.925300 0.083090 O\n0.307816 0.074700 0.916910 O\n0.056077 0.339271 0.179541 O\n0.943923 0.660729 0.820459 O\n0.566314 0.821884 0.666679 O\n0.433686 0.178116 0.333321 O\n0.169968 0.756887 0.665320 O\n0.830032 0.243113 0.334680 O\n0.927253 0.892929 0.664226 O\n0.072747 0.107071 0.335774 O\n0.820348 0.590880 0.437688 O\n0.179652 0.409120 0.562312 O\n0.167614 0.643195 0.414000 O\n0.832386 0.356805 0.586000 O\n0.891919 0.008578 0.897075 O\n0.108081 0.991422 0.102925 O\n0.401745 0.508938 0.381880 O\n0.598255 0.491062 0.618120 O\n0.331080 0.825022 0.048294 O\n0.668920 0.174978 0.951706 O\n0.465710 0.651033 0.847809 O\n0.534290 0.348967 0.152191 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Pu",
"Te",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pu-Te",
"density": 5.677485287123293,
"density_atomic": 0.05216590451262722,
"volume": 728.4451473625223,
"volume_molar": 11.544208456200137,
"formula_full": "Pu4 Te8 Cl4 O22",
"formula_reduced": "Pu2Te4Cl2O11",
"formula_anonymous": "A2B2C4D11",
"energy": -278.43540146,
"energy_per_atom": -7.327247406842105,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -260.86540146,
"band_gap": 0.2320000000000002,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 15.9992773,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:11.394000Z",
"spacegroup": 2
},
{
"id": "mp-1197213",
"created_at": "2022-09-04T14:43:08.097983Z",
"structure_string": "Pu4 Te4 S4 O28\n1.0\n13.743831 0.000000 0.000000\n0.000000 5.555643 0.000000\n0.000000 2.475100 7.212086\nPu Te S O\n4 4 4 28\ndirect\n0.132285 0.413523 0.414546 Pu\n0.632285 0.086477 0.585454 Pu\n0.867715 0.586477 0.585454 Pu\n0.367715 0.913523 0.414546 Pu\n0.126813 0.727841 0.738057 Te\n0.626813 0.772159 0.261943 Te\n0.873187 0.272159 0.261943 Te\n0.373187 0.227841 0.738057 Te\n0.138312 0.102073 0.122893 S\n0.638312 0.397927 0.877107 S\n0.861688 0.897927 0.877107 S\n0.361688 0.602073 0.122893 S\n0.221068 0.669300 0.570724 O\n0.721068 0.830700 0.429276 O\n0.778932 0.330700 0.429276 O\n0.278932 0.169300 0.570724 O\n0.218425 0.131093 0.252106 O\n0.718425 0.368907 0.747894 O\n0.781575 0.868907 0.747894 O\n0.281575 0.631093 0.252106 O\n0.041471 0.544141 0.629243 O\n0.541471 0.955859 0.370757 O\n0.958529 0.455859 0.370757 O\n0.458529 0.044141 0.629243 O\n0.064989 0.293692 0.142924 O\n0.564989 0.206308 0.857076 O\n0.935011 0.706308 0.857076 O\n0.435011 0.793692 0.142924 O\n0.173329 0.171512 0.931480 O\n0.673329 0.328488 0.068520 O\n0.826671 0.828488 0.068520 O\n0.326671 0.671512 0.931480 O\n0.097800 0.842135 0.188047 O\n0.597800 0.657865 0.811953 O\n0.902200 0.157865 0.811953 O\n0.402200 0.342135 0.188047 O\n0.086107 0.052912 0.580480 O\n0.586107 0.447088 0.419520 O\n0.913893 0.947088 0.419520 O\n0.413893 0.552912 0.580480 O\n",
"nsites": 40,
"nelements": 4,
"elements": [
"Pu",
"Te",
"S",
"O"
],
"chemical_system": "O-Pu-S-Te",
"density": 6.219710535516033,
"density_atomic": 0.07263684256060673,
"volume": 550.6847295382477,
"volume_molar": 8.290752389154642,
"formula_full": "Pu4 Te4 S4 O28",
"formula_reduced": "PuTeSO7",
"formula_anonymous": "ABCD7",
"energy": -314.81862659,
"energy_per_atom": -7.87046566475,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -295.58262659,
"band_gap": 0.2987999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 16.0002692,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:01.811000Z",
"spacegroup": 14
},
{
"id": "mp-1219843",
"created_at": "2022-09-04T14:46:59.197173Z",
"structure_string": "Pu1 U3 W4 C6\n1.0\n0.000000 3.166420 0.000000\n0.230508 0.000000 5.568234\n11.218262 0.000000 2.156309\nPu U W C\n1 3 4 6\ndirect\n0.500000 0.734193 0.103458 Pu\n0.000000 0.230295 0.603890 U\n0.000000 0.770214 0.394255 U\n0.500000 0.268423 0.895059 U\n0.500000 0.286047 0.349763 W\n0.000000 0.781720 0.844868 W\n0.000000 0.223187 0.155676 W\n0.500000 0.714054 0.653161 W\n0.000000 0.492789 0.997149 C\n0.500000 0.997928 0.500736 C\n0.000000 0.503592 0.255492 C\n0.500000 0.005676 0.752680 C\n0.500000 0.000700 0.247126 C\n0.000000 0.491183 0.746687 C\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Pu",
"U",
"W",
"C"
],
"chemical_system": "C-Pu-U-W",
"density": 14.940924505279138,
"density_atomic": 0.07134868923240567,
"volume": 196.21944215958177,
"volume_molar": 8.440436432383429,
"formula_full": "Pu1 U3 W4 C6",
"formula_reduced": "PuU3(W2C3)2",
"formula_anonymous": "AB3C4D6",
"energy": -155.63383468,
"energy_per_atom": -11.116702477142857,
"energy_above_hull": null,
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:47.350000Z",
"spacegroup": 6
},
{
"id": "mp-1111735",
"created_at": "2022-09-04T14:46:13.835861Z",
"structure_string": "Rb2 Ag1 As1 Br6\n1.0\n0.000000 5.511100 5.511100\n5.511100 0.000000 5.511100\n5.511100 5.511100 0.000000\nRb Ag As Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 As\n0.756847 0.243153 0.243153 Br\n0.243153 0.243153 0.756847 Br\n0.243153 0.756847 0.756847 Br\n0.243153 0.756847 0.243153 Br\n0.756847 0.243153 0.756847 Br\n0.756847 0.756847 0.243153 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"As",
"Br"
],
"chemical_system": "Ag-As-Br-Rb",
"density": 4.132635607443658,
"density_atomic": 0.02987136922431239,
"volume": 334.768718665262,
"volume_molar": 20.16024345847047,
"formula_full": "Rb2 Ag1 As1 Br6",
"formula_reduced": "Rb2AgAsBr6",
"formula_anonymous": "ABC2D6",
"energy": -32.19184063,
"energy_per_atom": -3.219184063,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:37:27.438000Z",
"spacegroup": 225
},
{
"id": "mp-1111655",
"created_at": "2022-09-04T14:41:02.360066Z",
"structure_string": "Rb2 Ag1 As1 Cl6\n1.0\n0.000000 5.232068 5.232068\n5.232068 0.000000 5.232068\n5.232068 5.232068 0.000000\nRb Ag As Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 As\n0.759162 0.240838 0.240838 Cl\n0.240838 0.240838 0.759162 Cl\n0.240838 0.759162 0.759162 Cl\n0.240838 0.759162 0.240838 Cl\n0.759162 0.240838 0.759162 Cl\n0.759162 0.759162 0.240838 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"As",
"Cl"
],
"chemical_system": "Ag-As-Cl-Rb",
"density": 3.283639591315527,
"density_atomic": 0.03491000130082658,
"volume": 286.45086300134926,
"volume_molar": 17.250474178176013,
"formula_full": "Rb2 Ag1 As1 Cl6",
"formula_reduced": "Rb2AgAsCl6",
"formula_anonymous": "ABC2D6",
"energy": -35.92372869,
"energy_per_atom": -3.5923728689999996,
"energy_above_hull": null,
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"energy_uncorrected": -32.23972869,
"band_gap": 1.2952,
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"is_magnetic": false,
"total_magnetization": 0.0001365,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.835000Z",
"spacegroup": 225
},
{
"id": "mp-1110613",
"created_at": "2022-09-04T14:48:06.358751Z",
"structure_string": "Rb2 Ag1 As1 F6\n1.0\n0.000000 4.521419 4.521419\n4.521419 0.000000 4.521419\n4.521419 4.521419 0.000000\nRb Ag As F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 As\n0.771138 0.228862 0.228862 F\n0.228862 0.228862 0.771138 F\n0.228862 0.771138 0.771138 F\n0.228862 0.771138 0.228862 F\n0.771138 0.228862 0.771138 F\n0.771138 0.771138 0.228862 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"As",
"F"
],
"chemical_system": "Ag-As-F-Rb",
"density": 4.201234235320557,
"density_atomic": 0.05409358183105611,
"volume": 184.86481503908877,
"volume_molar": 11.132819377367575,
"formula_full": "Rb2 Ag1 As1 F6",
"formula_reduced": "Rb2AgAsF6",
"formula_anonymous": "ABC2D6",
"energy": -45.25112324,
"energy_per_atom": -4.525112324,
"energy_above_hull": null,
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"energy_uncorrected": -42.47912323999999,
"band_gap": 2.3267,
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"total_magnetization": 0.0007799,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:25.731000Z",
"spacegroup": 225
},
{
"id": "mp-570593",
"created_at": "2022-09-04T14:41:08.152632Z",
"structure_string": "Rb4 Ag8 As12 Se24\n1.0\n7.822502 0.000000 0.000000\n0.000000 10.167588 0.000000\n0.000000 10.078346 17.632969\nRb Ag As Se\n4 8 12 24\ndirect\n0.175115 0.161038 0.832377 Rb\n0.824885 0.838962 0.167623 Rb\n0.324885 0.161038 0.332377 Rb\n0.675115 0.838962 0.667623 Rb\n0.461640 0.452153 0.080778 Ag\n0.484979 0.350225 0.499310 Ag\n0.984979 0.649775 0.000690 Ag\n0.538360 0.547847 0.919222 Ag\n0.961640 0.547847 0.419222 Ag\n0.515021 0.649775 0.500690 Ag\n0.015021 0.350225 0.999310 Ag\n0.038360 0.452153 0.580778 Ag\n0.849539 0.953510 0.353380 As\n0.369662 0.653405 0.276775 As\n0.618324 0.213412 0.918587 As\n0.118324 0.786588 0.581413 As\n0.150461 0.046490 0.646620 As\n0.881676 0.213412 0.418587 As\n0.650461 0.953510 0.853380 As\n0.869662 0.346595 0.223225 As\n0.381676 0.786588 0.081413 As\n0.349539 0.046490 0.146620 As\n0.130338 0.653405 0.776775 As\n0.630338 0.346595 0.723225 As\n0.249646 0.453715 0.892043 Se\n0.250354 0.453715 0.392043 Se\n0.803114 0.134028 0.735626 Se\n0.303114 0.865972 0.764374 Se\n0.720368 0.409785 0.310971 Se\n0.279632 0.590215 0.689029 Se\n0.304560 0.733307 0.982767 Se\n0.702258 0.731833 0.371967 Se\n0.779632 0.409785 0.810971 Se\n0.297742 0.268167 0.628033 Se\n0.202258 0.268167 0.128033 Se\n0.804560 0.266693 0.517233 Se\n0.797742 0.731833 0.871967 Se\n0.696886 0.134028 0.235626 Se\n0.203774 0.012569 0.048653 Se\n0.796226 0.987431 0.951347 Se\n0.296226 0.012569 0.548653 Se\n0.695440 0.266693 0.017233 Se\n0.220368 0.590215 0.189029 Se\n0.703774 0.987431 0.451347 Se\n0.195440 0.733307 0.482767 Se\n0.749646 0.546285 0.607957 Se\n0.196886 0.865972 0.264374 Se\n0.750354 0.546285 0.107957 Se\n",
"nsites": 48,
"nelements": 4,
"elements": [
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"Ag",
"As",
"Se"
],
"chemical_system": "Ag-As-Rb-Se",
"density": 4.734807341144932,
"density_atomic": 0.03422568670874987,
"volume": 1402.455425028147,
"volume_molar": 17.595383289885685,
"formula_full": "Rb4 Ag8 As12 Se24",
"formula_reduced": "RbAg2(AsSe2)3",
"formula_anonymous": "AB2C3D6",
"energy": -191.90118026,
"energy_per_atom": -3.9979412554166665,
"energy_above_hull": null,
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"energy_uncorrected": -180.57318026,
"band_gap": 1.0057,
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},
{
"id": "mp-541916",
"created_at": "2022-09-04T14:44:46.709635Z",
"structure_string": "Rb8 Ag4 As12 Se24\n1.0\n8.034551 0.000000 0.000000\n0.000000 13.085470 0.000000\n0.000000 11.355543 14.736285\nRb Ag As Se\n8 4 12 24\ndirect\n0.899080 0.585371 0.763258 Rb\n0.399080 0.414629 0.736742 Rb\n0.100920 0.414629 0.236742 Rb\n0.600920 0.585371 0.263258 Rb\n0.371858 0.780884 0.389343 Rb\n0.871858 0.219116 0.110657 Rb\n0.628142 0.219116 0.610657 Rb\n0.128142 0.780884 0.889343 Rb\n0.993213 0.527626 0.573033 Ag\n0.493213 0.472374 0.926967 Ag\n0.006787 0.472374 0.426967 Ag\n0.506787 0.527626 0.073033 Ag\n0.089815 0.221769 0.651922 As\n0.589815 0.778231 0.848078 As\n0.910185 0.778231 0.348078 As\n0.410185 0.221769 0.151922 As\n0.958419 0.166096 0.862782 As\n0.458419 0.833904 0.637218 As\n0.041581 0.833904 0.137218 As\n0.541581 0.166096 0.362782 As\n0.332485 0.115382 0.006166 As\n0.832485 0.884618 0.493834 As\n0.667515 0.884618 0.993834 As\n0.167515 0.115382 0.506166 As\n0.238649 0.052046 0.657788 Se\n0.738649 0.947954 0.842212 Se\n0.761351 0.947954 0.342212 Se\n0.261351 0.052046 0.157788 Se\n0.742475 0.587982 0.446261 Se\n0.242475 0.412018 0.053739 Se\n0.257525 0.412018 0.553739 Se\n0.757525 0.587982 0.946261 Se\n0.204752 0.119312 0.804529 Se\n0.704752 0.880688 0.695471 Se\n0.795248 0.880688 0.195471 Se\n0.295248 0.119312 0.304529 Se\n0.830098 0.344824 0.729073 Se\n0.330098 0.655176 0.770927 Se\n0.169902 0.655176 0.270927 Se\n0.669902 0.344824 0.229073 Se\n0.106022 0.275908 0.915629 Se\n0.606022 0.724092 0.584371 Se\n0.893978 0.724092 0.084371 Se\n0.393978 0.275908 0.415629 Se\n0.069068 0.750983 0.540082 Se\n0.569068 0.249017 0.959918 Se\n0.930932 0.249017 0.459918 Se\n0.430932 0.750983 0.040082 Se\n",
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],
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"volume_molar": 19.437867399234023,
"formula_full": "Rb8 Ag4 As12 Se24",
"formula_reduced": "Rb2Ag(AsSe2)3",
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},
{
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],
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"density": 4.91539767475008,
"density_atomic": 0.03098973115800605,
"volume": 322.6875363653017,
"volume_molar": 19.432697654894657,
"formula_full": "Rb2 Ag1 Au1 Br6",
"formula_reduced": "Rb2AgAuBr6",
"formula_anonymous": "ABC2D6",
"energy": -29.65353244,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:43.143000Z",
"spacegroup": 225
},
{
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"structure_string": "Rb2 Ag1 Au1 Cl6\n1.0\n0.000000 5.167795 5.167795\n5.167795 0.000000 5.167795\n5.167795 5.167795 0.000000\nRb Ag Au Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Au\n0.752659 0.247341 0.247341 Cl\n0.247341 0.247341 0.752659 Cl\n0.247341 0.752659 0.752659 Cl\n0.247341 0.752659 0.247341 Cl\n0.752659 0.247341 0.752659 Cl\n0.752659 0.752659 0.247341 Cl\n",
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"Au",
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],
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"density": 4.14190255762106,
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"volume": 276.023353451574,
"volume_molar": 16.622514875326104,
"formula_full": "Rb2 Ag1 Au1 Cl6",
"formula_reduced": "Rb2AgAuCl6",
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"updated_at": "2021-11-28T01:34:48.158000Z",
"spacegroup": 225
}
]
}