{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=id&page=38","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=id&page=36","results":[{"id":"mp-1008635","created_at":"2022-09-04T14:42:48.660577Z","structure_string":"W1 C1\n1.0\n0.000000 2.354692 2.354692\n2.354692 0.000000 2.354692\n2.354692 2.354692 0.000000\nW C\n1 1\ndirect\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 C\n","nsites":2,"nelements":2,"elements":["W","C"],"chemical_system":"C-W","density":12.454947608219916,"density_atomic":0.07659451580315613,"volume":26.111530036169885,"volume_molar":7.8623654668391465,"formula_full":"W1 C1","formula_reduced":"WC","formula_anonymous":"AB","energy":-21.08443661,"energy_per_atom":-10.542218305,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-21.08443661,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001859,"is_theoretical":true,"updated_at":"2021-11-28T01:35:49.073000Z","spacegroup":216},{"id":"mp-1008642","created_at":"2022-09-04T14:47:26.845891Z","structure_string":"U1 C2\n1.0\n0.000000 2.693524 2.693524\n2.693524 0.000000 2.693524\n2.693524 2.693524 0.000000\nU C\n1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.750000 0.750000 0.750000 C\n0.250000 0.250000 0.250000 C\n","nsites":3,"nelements":2,"elements":["U","C"],"chemical_system":"C-U","density":11.133743989517901,"density_atomic":0.07675889432893798,"volume":39.083418621742766,"volume_molar":7.8455282774046715,"formula_full":"U1 C2","formula_reduced":"UC2","formula_anonymous":"AB2","energy":-28.1397647,"energy_per_atom":-9.379921566666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-28.1397647,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0019984,"is_theoretical":true,"updated_at":"2021-11-28T01:38:06.365000Z","spacegroup":225},{"id":"mp-1008650","created_at":"2022-09-04T14:48:09.238226Z","structure_string":"Ce1 Se1\n1.0\n3.647622 0.000000 0.000000\n0.000000 3.647622 0.000000\n0.000000 0.000000 3.647622\nCe Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Se\n","nsites":2,"nelements":2,"elements":["Ce","Se"],"chemical_system":"Ce-Se","density":7.495738393739383,"density_atomic":0.041209800911861105,"volume":48.53214419253249,"volume_molar":14.613370185602362,"formula_full":"Ce1 Se1","formula_reduced":"CeSe","formula_anonymous":"AB","energy":-13.01781038,"energy_per_atom":-6.50890519,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.54581038,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.7666529,"is_theoretical":true,"updated_at":"2021-11-28T01:38:30.085000Z","spacegroup":221},{"id":"mp-1008653","created_at":"2022-09-04T14:46:34.763818Z","structure_string":"Ag1 C1\n1.0\n0.000000 2.333879 2.333879\n2.333879 0.000000 2.333879\n2.333879 2.333879 0.000000\nAg C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 C\n","nsites":2,"nelements":2,"elements":["Ag","C"],"chemical_system":"Ag-C","density":7.829370446328863,"density_atomic":0.07866200124670868,"volume":25.425236687373022,"volume_molar":7.655717709383823,"formula_full":"Ag1 C1","formula_reduced":"AgC","formula_anonymous":"AB","energy":-7.58829153,"energy_per_atom":-3.794145765,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-7.58829153,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003218,"is_theoretical":true,"updated_at":"2021-11-28T01:37:43.067000Z","spacegroup":225},{"id":"mp-1008661","created_at":"2022-09-04T14:41:54.722233Z","structure_string":"Au1 C1\n1.0\n1.625520 -2.815483 0.000000\n1.625520 2.815483 0.000000\n0.000000 0.000000 2.926102\nAu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Au\n0.333333 0.666667 0.500000 C\n","nsites":2,"nelements":2,"elements":["Au","C"],"chemical_system":"Au-C","density":12.95637362834994,"density_atomic":0.07467329449696186,"volume":26.78333684716926,"volume_molar":8.064651225807394,"formula_full":"Au1 C1","formula_reduced":"AuC","formula_anonymous":"AB","energy":-8.00759774,"energy_per_atom":-4.00379887,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.00759774,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003241,"is_theoretical":true,"updated_at":"2021-11-28T01:35:38.531000Z","spacegroup":187},{"id":"mp-1008669","created_at":"2022-09-04T14:42:04.436755Z","structure_string":"U1\n1.0\n0.000000 2.216057 2.216057\n2.216057 0.000000 2.216057\n2.216057 2.216057 0.000000\nU\n1\ndirect\n0.000000 0.000000 0.000000 U\n","nsites":1,"nelements":1,"elements":["U"],"chemical_system":"U","density":18.159589588452988,"density_atomic":0.04594383290806428,"volume":21.76570687955108,"volume_molar":13.107615056955694,"formula_full":"U1","formula_reduced":"U","formula_anonymous":"A","energy":-10.91983266,"energy_per_atom":-10.91983266,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.91983266,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0970341,"is_theoretical":true,"updated_at":"2021-11-28T01:35:33.974000Z","spacegroup":225},{"id":"mp-1008673","created_at":"2022-09-04T14:42:08.166354Z","structure_string":"Tm1 Cd2\n1.0\n2.703082 -4.681876 0.000000\n2.703082 4.681876 0.000000\n0.000000 0.000000 3.201164\nTm Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.666667 0.333333 0.952799 Cd\n0.333333 0.666667 0.047201 Cd\n","nsites":3,"nelements":2,"elements":["Tm","Cd"],"chemical_system":"Cd-Tm","density":8.069738582222286,"density_atomic":0.03702577921654078,"volume":81.02462833948378,"volume_molar":16.264723896235214,"formula_full":"Tm1 Cd2","formula_reduced":"TmCd2","formula_anonymous":"AB2","energy":-5.91589471,"energy_per_atom":-1.9719649033333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.91589471,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0010113,"is_theoretical":false,"updated_at":"2021-11-28T01:35:38.841000Z","spacegroup":164},{"id":"mp-1008676","created_at":"2022-09-04T14:39:24.826805Z","structure_string":"Ti1 S2\n1.0\n2.156773 -3.735641 0.000000\n2.156773 3.735641 0.000000\n0.000000 0.000000 2.931109\nTi S\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.666667 0.333333 0.500000 S\n0.333333 0.666667 0.500000 S\n","nsites":3,"nelements":2,"elements":["Ti","S"],"chemical_system":"S-Ti","density":3.9375306834200887,"density_atomic":0.06351696214336794,"volume":47.231477998404905,"volume_molar":9.48115362697458,"formula_full":"Ti1 S2","formula_reduced":"TiS2","formula_anonymous":"AB2","energy":-17.14212463,"energy_per_atom":-5.714041543333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.13612463,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":8.14e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:34:35.581000Z","spacegroup":191},{"id":"mp-1008677","created_at":"2022-09-04T14:43:59.638921Z","structure_string":"Ti1 O2\n1.0\n0.000000 2.420000 2.420000\n2.420000 0.000000 2.420000\n2.420000 2.420000 0.000000\nTi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 O\n0.250000 0.250000 0.250000 O\n","nsites":3,"nelements":2,"elements":["Ti","O"],"chemical_system":"O-Ti","density":4.678793200786703,"density_atomic":0.10583886188508328,"volume":28.344976,"volume_molar":5.689914510360725,"formula_full":"Ti1 O2","formula_reduced":"TiO2","formula_anonymous":"AB2","energy":-27.39060585,"energy_per_atom":-9.13020195,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.01660585,"band_gap":1.0564999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.66e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:22.395000Z","spacegroup":225},{"id":"mp-1008680","created_at":"2022-09-04T14:43:22.787115Z","structure_string":"Ti1 Ge1 Pt1\n1.0\n0.000000 2.995355 2.995355\n2.995355 0.000000 2.995355\n2.995355 2.995355 0.000000\nTi Ge Pt\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ge\n0.250000 0.250000 0.250000 Pt\n","nsites":3,"nelements":3,"elements":["Ti","Ge","Pt"],"chemical_system":"Ge-Pt-Ti","density":9.749869625519475,"density_atomic":0.0558144122901009,"volume":53.74955816800873,"volume_molar":10.78958016918521,"formula_full":"Ti1 Ge1 Pt1","formula_reduced":"TiGePt","formula_anonymous":"ABC","energy":-21.19155657,"energy_per_atom":-7.0638521899999995,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-21.19155657,"band_gap":0.8822000000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.65e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:36:12.800000Z","spacegroup":216},{"id":"mp-1008681","created_at":"2022-09-04T14:42:19.616764Z","structure_string":"Sc1\n1.0\n2.989426 0.000000 0.000000\n0.000000 2.989426 0.000000\n0.000000 0.000000 2.989426\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":2.7942965058753915,"density_atomic":0.03743144369837954,"volume":26.715507103010598,"volume_molar":16.088454424910964,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-5.61301517,"energy_per_atom":-5.61301517,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.61301517,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.9076781,"is_theoretical":true,"updated_at":"2021-11-28T01:35:44.836000Z","spacegroup":221},{"id":"mp-1008682","created_at":"2022-09-04T14:45:56.404252Z","structure_string":"Ti1 S2\n1.0\n-1.576078 1.576078 4.779394\n1.576078 -1.576078 4.779394\n1.576078 1.576078 -4.779394\nTi S\n1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.863104 0.863104 0.000000 S\n0.136896 0.136896 0.000000 S\n","nsites":3,"nelements":2,"elements":["Ti","S"],"chemical_system":"S-Ti","density":3.9162215053456,"density_atomic":0.06317322024879356,"volume":47.48847673405239,"volume_molar":9.53274304568162,"formula_full":"Ti1 S2","formula_reduced":"TiS2","formula_anonymous":"AB2","energy":-19.66032472,"energy_per_atom":-6.553441573333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.65432472,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0102419,"is_theoretical":true,"updated_at":"2021-11-28T01:37:13.223000Z","spacegroup":139}]}