{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-id&page=12175","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-id&page=12173","results":[{"id":"mp-10061","created_at":"2022-09-04T14:48:31.058488Z","structure_string":"Er1 B1 Pd3\n1.0\n4.304722 0.000000 0.000000\n0.000000 4.304722 0.000000\n0.000000 0.000000 4.304722\nEr B Pd\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n","nsites":5,"nelements":3,"elements":["Er","B","Pd"],"chemical_system":"B-Er-Pd","density":10.352814333897127,"density_atomic":0.06268082078541373,"volume":79.76921708025137,"volume_molar":9.607629071445398,"formula_full":"Er1 B1 Pd3","formula_reduced":"ErBPd3","formula_anonymous":"ABC3","energy":-29.98301155,"energy_per_atom":-5.99660231,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.98301155,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002976,"is_theoretical":false,"updated_at":"2021-11-28T01:40:00.831000Z","spacegroup":221},{"id":"mp-1006099","created_at":"2022-09-04T14:40:13.209331Z","structure_string":"Lu4 B16 Rh16\n1.0\n-3.758371 3.758371 7.448065\n3.758371 -3.758371 7.448065\n3.758371 3.758371 -7.448065\nLu B Rh\n4 16 16\ndirect\n0.750000 0.750000 0.000000 Lu\n0.500000 0.000000 0.500000 Lu\n0.000000 0.500000 0.500000 Lu\n0.250000 0.250000 0.000000 Lu\n0.747643 0.054825 0.967049 B\n0.087776 0.780594 0.032951 B\n0.502357 0.969406 0.807183 B\n0.162224 0.695175 0.192817 B\n0.445175 0.752357 0.032951 B\n0.719406 0.412224 0.967049 B\n0.530594 0.997643 0.192817 B\n0.804825 0.337776 0.807183 B\n0.002357 0.195175 0.532951 B\n0.662224 0.469406 0.467049 B\n0.247643 0.280594 0.692817 B\n0.587776 0.554825 0.307183 B\n0.304825 0.497643 0.467049 B\n0.030594 0.837776 0.532951 B\n0.219406 0.252357 0.307183 B\n0.945175 0.912224 0.692817 B\n0.696783 0.159072 0.229268 Rh\n0.929805 0.467515 0.770732 Rh\n0.553217 0.282485 0.962289 Rh\n0.320195 0.590928 0.037711 Rh\n0.340928 0.803217 0.770732 Rh\n0.032485 0.570195 0.229268 Rh\n0.217515 0.946783 0.037711 Rh\n0.909072 0.179805 0.962289 Rh\n0.053217 0.090928 0.270732 Rh\n0.820195 0.782485 0.729268 Rh\n0.196783 0.967515 0.537711 Rh\n0.429805 0.659072 0.462289 Rh\n0.409072 0.446783 0.729268 Rh\n0.717515 0.679805 0.270732 Rh\n0.532485 0.303217 0.462289 Rh\n0.840928 0.070195 0.537711 Rh\n","nsites":36,"nelements":3,"elements":["Lu","B","Rh"],"chemical_system":"B-Lu-Rh","density":9.941038465979704,"density_atomic":0.0855460092866736,"volume":420.8261764655818,"volume_molar":7.039651306023147,"formula_full":"Lu4 B16 Rh16","formula_reduced":"Lu(BRh)4","formula_anonymous":"AB4C4","energy":-263.40312283,"energy_per_atom":-7.316753411944443,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-263.40312283,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0360925,"is_theoretical":false,"updated_at":"2021-11-28T01:34:53.680000Z","spacegroup":142},{"id":"mp-1006068","created_at":"2022-09-04T14:43:37.851641Z","structure_string":"Gd2 Ag1 Rh1\n1.0\n0.000000 3.566919 3.566919\n3.566919 0.000000 3.566919\n3.566919 3.566919 0.000000\nGd Ag Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Gd\n0.750000 0.750000 0.750000 Gd\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Rh\n","nsites":4,"nelements":3,"elements":["Gd","Ag","Rh"],"chemical_system":"Ag-Gd-Rh","density":9.610036049303663,"density_atomic":0.0440707309865928,"volume":90.76318705076346,"volume_molar":13.664717206147671,"formula_full":"Gd2 Ag1 Rh1","formula_reduced":"Gd2AgRh","formula_anonymous":"ABC2","energy":-40.47815757,"energy_per_atom":-10.1195393925,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-40.47815757,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":14.2549012,"is_theoretical":true,"updated_at":"2021-11-28T01:36:19.142000Z","spacegroup":225},{"id":"mp-1006059","created_at":"2022-09-04T14:43:11.958957Z","structure_string":"Tl6 Bi2\n1.0\n3.729055 -6.458913 0.000000\n3.729055 6.458913 0.000000\n0.000000 0.000000 5.389167\nTl Bi\n6 2\ndirect\n0.169781 0.339562 0.250000 Tl\n0.660438 0.830219 0.250000 Tl\n0.169781 0.830219 0.250000 Tl\n0.830219 0.660438 0.750000 Tl\n0.339562 0.169781 0.750000 Tl\n0.830219 0.169781 0.750000 Tl\n0.333333 0.666667 0.750000 Bi\n0.666667 0.333333 0.250000 Bi\n","nsites":8,"nelements":2,"elements":["Tl","Bi"],"chemical_system":"Bi-Tl","density":10.517436213013115,"density_atomic":0.030816273931747514,"volume":259.6030921103102,"volume_molar":19.542079530244166,"formula_full":"Tl6 Bi2","formula_reduced":"Tl3Bi","formula_anonymous":"AB3","energy":-22.24317093,"energy_per_atom":-2.78039636625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.24317093,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0020382,"is_theoretical":true,"updated_at":"2021-11-28T01:36:16.018000Z","spacegroup":194},{"id":"mp-1006058","created_at":"2022-09-04T14:45:28.584555Z","structure_string":"U2 Cd4 O10\n1.0\n2.690569 5.772214 0.000000\n-2.690569 5.772214 0.000000\n0.000000 2.748697 7.742824\nU Cd O\n2 4 10\ndirect\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 U\n0.628536 0.703758 0.682338 Cd\n0.296242 0.371464 0.817662 Cd\n0.703758 0.628536 0.182338 Cd\n0.371464 0.296242 0.317662 Cd\n0.141866 0.632685 0.479130 O\n0.858134 0.367315 0.520870 O\n0.617767 0.071321 0.625410 O\n0.193880 0.806120 0.750000 O\n0.928679 0.382233 0.874590 O\n0.632685 0.141866 0.979130 O\n0.367315 0.858134 0.020870 O\n0.071321 0.617767 0.125410 O\n0.806120 0.193880 0.250000 O\n0.382233 0.928679 0.374590 O\n","nsites":16,"nelements":3,"elements":["U","Cd","O"],"chemical_system":"Cd-O-U","density":7.496202710641328,"density_atomic":0.06652793472790734,"volume":240.50047646057874,"volume_molar":9.052048263079199,"formula_full":"U2 Cd4 O10","formula_reduced":"UCd2O5","formula_anonymous":"AB2C5","energy":-115.90637208,"energy_per_atom":-7.244148255,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-109.03637208,"band_gap":2.0853,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001359,"is_theoretical":false,"updated_at":"2021-11-28T01:36:57.767000Z","spacegroup":15},{"id":"mp-1006057","created_at":"2022-09-04T14:40:12.804608Z","structure_string":"La1 Pr1 In2\n1.0\n0.000000 3.936026 3.936026\n3.936026 0.000000 3.936026\n3.936026 3.936026 0.000000\nLa Pr In\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Pr\n0.750000 0.750000 0.750000 In\n0.250000 0.250000 0.250000 In\n","nsites":4,"nelements":3,"elements":["La","Pr","In"],"chemical_system":"In-La-Pr","density":6.936590271902152,"density_atomic":0.03279866144534892,"volume":121.95619649494046,"volume_molar":18.360934546168753,"formula_full":"La1 Pr1 In2","formula_reduced":"LaPrIn2","formula_anonymous":"ABC2","energy":-17.19012738,"energy_per_atom":-4.297531845,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.19012738,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004296,"is_theoretical":true,"updated_at":"2021-11-28T01:34:49.182000Z","spacegroup":225},{"id":"mp-1006056","created_at":"2022-09-04T14:41:27.112396Z","structure_string":"Pa1 Ni2 Ge1\n1.0\n0.000000 3.188611 3.188611\n3.188611 0.000000 3.188611\n3.188611 3.188611 0.000000\nPa Ni Ge\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Pa\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ni\n0.500000 0.500000 0.500000 Ge\n","nsites":4,"nelements":3,"elements":["Pa","Ni","Ge"],"chemical_system":"Ge-Ni-Pa","density":10.783536985134958,"density_atomic":0.06169150648790874,"volume":64.83874730444428,"volume_molar":9.76170157423585,"formula_full":"Pa1 Ni2 Ge1","formula_reduced":"PaNi2Ge","formula_anonymous":"ABC2","energy":-27.31495738,"energy_per_atom":-6.828739345,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.31495738,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0063826,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.129000Z","spacegroup":225},{"id":"mp-10060","created_at":"2022-09-04T14:39:24.682454Z","structure_string":"Dy1 B1 Pd3\n1.0\n4.319571 0.000000 0.000000\n0.000000 4.319571 0.000000\n0.000000 0.000000 4.319571\nDy B Pd\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n","nsites":5,"nelements":3,"elements":["Dy","B","Pd"],"chemical_system":"B-Dy-Pd","density":10.148365174039759,"density_atomic":0.062036623738577094,"volume":80.5975518762924,"volume_molar":9.707396046208697,"formula_full":"Dy1 B1 Pd3","formula_reduced":"DyBPd3","formula_anonymous":"ABC3","energy":-29.96260226,"energy_per_atom":-5.992520452,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.96260226,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006678,"is_theoretical":false,"updated_at":"2021-11-28T01:34:41.780000Z","spacegroup":221},{"id":"mp-1005986","created_at":"2022-09-04T14:40:04.386284Z","structure_string":"Zr18 Co2 Mo8\n1.0\n4.403451 -7.627001 0.000000\n4.403451 7.627001 0.000000\n0.000000 0.000000 8.444279\nZr Co Mo\n18 2 8\ndirect\n0.542457 0.084914 0.250000 Zr\n0.457543 0.915086 0.750000 Zr\n0.915086 0.457543 0.250000 Zr\n0.542457 0.457543 0.250000 Zr\n0.457543 0.542457 0.750000 Zr\n0.084914 0.542457 0.750000 Zr\n0.200940 0.401879 0.057777 Zr\n0.799060 0.598121 0.557777 Zr\n0.598121 0.799060 0.057777 Zr\n0.200940 0.799060 0.057777 Zr\n0.799060 0.200940 0.557777 Zr\n0.401879 0.200940 0.557777 Zr\n0.799060 0.598121 0.942223 Zr\n0.799060 0.200940 0.942223 Zr\n0.401879 0.200940 0.942223 Zr\n0.598121 0.799060 0.442223 Zr\n0.200940 0.799060 0.442223 Zr\n0.200940 0.401879 0.442223 Zr\n0.333333 0.666667 0.250000 Co\n0.666667 0.333333 0.750000 Co\n0.000000 0.000000 0.000000 Mo\n0.000000 0.000000 0.500000 Mo\n0.889522 0.779045 0.250000 Mo\n0.110478 0.220955 0.750000 Mo\n0.220955 0.110478 0.250000 Mo\n0.889522 0.110478 0.250000 Mo\n0.110478 0.889522 0.750000 Mo\n0.779045 0.889522 0.750000 Mo\n","nsites":28,"nelements":3,"elements":["Zr","Co","Mo"],"chemical_system":"Co-Mo-Zr","density":7.399232901821624,"density_atomic":0.049364925996814094,"volume":567.2043345473071,"volume_molar":12.199229794021479,"formula_full":"Zr18 Co2 Mo8","formula_reduced":"Zr9CoMo4","formula_anonymous":"AB4C9","energy":-258.39383159,"energy_per_atom":-9.228351128214285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-258.39383159,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0005594,"is_theoretical":false,"updated_at":"2021-11-28T01:34:46.985000Z","spacegroup":194},{"id":"mp-1005955","created_at":"2022-09-04T14:40:43.643107Z","structure_string":"Tm6 Ni14 B4\n1.0\n2.514135 -4.354610 0.000000\n2.514135 4.354610 0.000000\n0.000000 0.000000 14.234629\nTm Ni B\n6 14 4\ndirect\n0.333333 0.666667 0.532418 Tm\n0.666667 0.333333 0.032418 Tm\n0.666667 0.333333 0.467582 Tm\n0.333333 0.666667 0.967582 Tm\n0.333333 0.666667 0.750000 Tm\n0.666667 0.333333 0.250000 Tm\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.165816 0.331632 0.148099 Ni\n0.834184 0.668368 0.648099 Ni\n0.668368 0.834184 0.148099 Ni\n0.165816 0.834184 0.148099 Ni\n0.834184 0.165816 0.648099 Ni\n0.331632 0.165816 0.648099 Ni\n0.834184 0.668368 0.851901 Ni\n0.834184 0.165816 0.851901 Ni\n0.331632 0.165816 0.851901 Ni\n0.668368 0.834184 0.351901 Ni\n0.165816 0.834184 0.351901 Ni\n0.165816 0.331632 0.351901 Ni\n0.333333 0.666667 0.250000 B\n0.666667 0.333333 0.750000 B\n0.000000 0.000000 0.250000 B\n0.000000 0.000000 0.750000 B\n","nsites":24,"nelements":3,"elements":["Tm","Ni","B"],"chemical_system":"B-Ni-Tm","density":10.008279710458991,"density_atomic":0.07700115400626996,"volume":311.68364045616454,"volume_molar":7.8208448142343885,"formula_full":"Tm6 Ni14 B4","formula_reduced":"Tm3Ni7B2","formula_anonymous":"A2B3C7","energy":-147.60582793,"energy_per_atom":-6.1502428304166665,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-147.60582793,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.005092,"is_theoretical":false,"updated_at":"2021-11-28T01:35:09.456000Z","spacegroup":194},{"id":"mp-10059","created_at":"2022-09-04T14:47:28.385871Z","structure_string":"Zr1 Co3 B2\n1.0\n2.437084 -4.221154 0.000000\n2.437084 4.221154 0.000000\n0.000000 0.000000 3.032072\nZr Co B\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n","nsites":6,"nelements":3,"elements":["Zr","Co","B"],"chemical_system":"B-Co-Zr","density":7.709830135820116,"density_atomic":0.0961789540061046,"volume":62.383710261801895,"volume_molar":6.261391405460458,"formula_full":"Zr1 Co3 B2","formula_reduced":"ZrCo3B2","formula_anonymous":"AB2C3","energy":-46.57120865,"energy_per_atom":-7.761868108333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-46.57120865,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0188981,"is_theoretical":false,"updated_at":"2021-11-28T01:38:04.070000Z","spacegroup":191},{"id":"mp-1005895","created_at":"2022-09-04T14:40:52.809828Z","structure_string":"Sm6 Gd2\n1.0\n3.637167 -6.299758 0.000000\n3.637167 6.299758 0.000000\n0.000000 0.000000 5.884404\nSm Gd\n6 2\ndirect\n0.169265 0.338531 0.250000 Sm\n0.661469 0.830735 0.250000 Sm\n0.169265 0.830735 0.250000 Sm\n0.830735 0.661469 0.750000 Sm\n0.338531 0.169265 0.750000 Sm\n0.830735 0.169265 0.750000 Sm\n0.333333 0.666667 0.750000 Gd\n0.666667 0.333333 0.250000 Gd\n","nsites":8,"nelements":2,"elements":["Sm","Gd"],"chemical_system":"Gd-Sm","density":7.492016773361367,"density_atomic":0.02966677928167605,"volume":269.6618977086357,"volume_molar":20.29927382012657,"formula_full":"Sm6 Gd2","formula_reduced":"Sm3Gd","formula_anonymous":"AB3","energy":-56.31179767,"energy_per_atom":-7.03897470875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-56.31179767,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0411454,"is_theoretical":true,"updated_at":"2021-11-28T01:35:01.290000Z","spacegroup":194}]}