{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=chemical_system&page=12162","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=chemical_system&page=12160","results":[{"id":"mp-1096120","created_at":"2022-09-04T14:45:33.603588Z","structure_string":"Zr1 Ti1 Tc2\n1.0\n-4.483324 5.686725 8.044539\n4.483324 -5.686725 8.044539\n4.483324 5.686725 -8.044539\nZr Ti Tc\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ti\n0.000000 0.242253 0.242253 Tc\n0.000000 0.757747 0.757747 Tc\n","nsites":4,"nelements":3,"elements":["Zr","Ti","Tc"],"chemical_system":"Tc-Ti-Zr","density":0.6782477405088086,"density_atomic":0.004875694500786374,"volume":820.3959455119393,"volume_molar":123.51349657015471,"formula_full":"Zr1 Ti1 Tc2","formula_reduced":"ZrTiTc2","formula_anonymous":"ABC2","energy":-23.11890011,"energy_per_atom":-5.7797250275,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-23.11890011,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.6798049,"is_theoretical":true,"updated_at":"2021-11-28T01:37:04.686000Z","spacegroup":71},{"id":"mp-631475","created_at":"2022-09-04T14:41:27.789540Z","structure_string":"Tl1 Zn2 Tc1\n1.0\n0.000000 3.241636 3.241636\n3.241636 0.000000 3.241636\n3.241636 3.241636 0.000000\nTl Zn Tc\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.750000 0.750000 Zn\n0.500000 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Tc\n","nsites":4,"nelements":3,"elements":["Tl","Zn","Tc"],"chemical_system":"Tc-Tl-Zn","density":10.55883765996999,"density_atomic":0.05871340337372259,"volume":68.12754448143974,"volume_molar":10.256841562509782,"formula_full":"Tl1 Zn2 Tc1","formula_reduced":"TlZn2Tc","formula_anonymous":"ABC2","energy":-13.0146385,"energy_per_atom":-3.253659625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.0146385,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.83e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:20.949000Z","spacegroup":216},{"id":"mp-1093986","created_at":"2022-09-04T14:45:54.352919Z","structure_string":"Zr2 Tl1 Tc1\n1.0\n-5.296662 7.270478 10.562975\n5.296662 -7.270478 10.562975\n5.296662 7.270478 -10.562975\nZr Tl Tc\n2 1 1\ndirect\n0.000000 0.211325 0.211325 Zr\n0.000000 0.788675 0.788675 Zr\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tc\n","nsites":4,"nelements":3,"elements":["Zr","Tl","Tc"],"chemical_system":"Tc-Tl-Zr","density":0.4947983915758999,"density_atomic":0.0024583772235178742,"volume":1627.0895946050555,"volume_molar":244.96406419607453,"formula_full":"Zr2 Tl1 Tc1","formula_reduced":"Zr2TlTc","formula_anonymous":"ABC2","energy":-18.07053743,"energy_per_atom":-4.5176343575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.07053743,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9995947,"is_theoretical":true,"updated_at":"2021-11-28T01:37:11.975000Z","spacegroup":71},{"id":"mp-1102890","created_at":"2022-09-04T14:47:22.391452Z","structure_string":"Tm4 Tc8\n1.0\n2.669511 -4.623729 0.000000\n2.669511 4.623729 0.000000\n0.000000 0.000000 8.830661\nTm Tc\n4 8\ndirect\n0.333333 0.666667 0.436236 Tm\n0.666667 0.333333 0.563764 Tm\n0.666667 0.333333 0.936236 Tm\n0.333333 0.666667 0.063764 Tm\n0.000000 0.000000 0.500000 Tc\n0.000000 0.000000 0.000000 Tc\n0.827713 0.172287 0.250000 Tc\n0.827713 0.655426 0.250000 Tc\n0.344574 0.172287 0.250000 Tc\n0.172287 0.827713 0.750000 Tc\n0.172287 0.344574 0.750000 Tc\n0.655426 0.827713 0.750000 Tc\n","nsites":12,"nelements":2,"elements":["Tm","Tc"],"chemical_system":"Tc-Tm","density":11.119272429495815,"density_atomic":0.05504703744465465,"volume":217.99538280447936,"volume_molar":10.93999066898882,"formula_full":"Tm4 Tc8","formula_reduced":"TmTc2","formula_anonymous":"AB2","energy":-103.76596346,"energy_per_atom":-8.647163621666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-103.76596346,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0538529,"is_theoretical":false,"updated_at":"2021-11-28T01:38:07.814000Z","spacegroup":194},{"id":"mp-865273","created_at":"2022-09-04T14:41:12.733451Z","structure_string":"Tm1 U1 Tc2\n1.0\n0.000000 3.380583 3.380583\n3.380583 0.000000 3.380583\n3.380583 3.380583 0.000000\nTm U Tc\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 U\n0.250000 0.250000 0.250000 Tc\n0.750000 0.750000 0.750000 Tc\n","nsites":4,"nelements":3,"elements":["Tm","U","Tc"],"chemical_system":"Tc-Tm-U","density":12.95791246239798,"density_atomic":0.051767260877438645,"volume":77.26891344454525,"volume_molar":11.633106828382699,"formula_full":"Tm1 U1 Tc2","formula_reduced":"TmUTc2","formula_anonymous":"ABC2","energy":-36.61301742,"energy_per_atom":-9.153254355,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.61301742,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.8084175,"is_theoretical":true,"updated_at":"2021-11-28T01:35:25.532000Z","spacegroup":225},{"id":"mp-865250","created_at":"2022-09-04T14:46:03.766228Z","structure_string":"Tm1 Tc2 W1\n1.0\n0.000000 3.229492 3.229492\n3.229492 0.000000 3.229492\n3.229492 3.229492 0.000000\nTm Tc W\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.250000 0.250000 0.250000 Tc\n0.750000 0.750000 0.750000 Tc\n0.000000 0.000000 0.000000 W\n","nsites":4,"nelements":3,"elements":["Tm","Tc","W"],"chemical_system":"Tc-Tm-W","density":13.527269917705432,"density_atomic":0.05937824488587948,"volume":67.36473952181812,"volume_molar":10.141998591528095,"formula_full":"Tm1 Tc2 W1","formula_reduced":"TmTc2W","formula_anonymous":"ABC2","energy":-38.33934374,"energy_per_atom":-9.584835935,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.33934374,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0007426,"is_theoretical":true,"updated_at":"2021-11-28T01:37:20.146000Z","spacegroup":225},{"id":"mp-865401","created_at":"2022-09-04T14:39:42.811843Z","structure_string":"Tm2 Zn1 Tc1\n1.0\n0.000000 3.440819 3.440819\n3.440819 0.000000 3.440819\n3.440819 3.440819 0.000000\nTm Zn Tc\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tm\n0.750000 0.750000 0.750000 Tm\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Tc\n","nsites":4,"nelements":3,"elements":["Tm","Zn","Tc"],"chemical_system":"Tc-Tm-Zn","density":10.21672634575186,"density_atomic":0.04909581938223381,"volume":81.47333215600574,"volume_molar":12.266096860742524,"formula_full":"Tm2 Zn1 Tc1","formula_reduced":"Tm2ZnTc","formula_anonymous":"ABC2","energy":-21.37937714,"energy_per_atom":-5.344844285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-21.37937714,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0031932,"is_theoretical":true,"updated_at":"2021-11-28T01:34:34.820000Z","spacegroup":225},{"id":"mp-1187817","created_at":"2022-09-04T14:42:02.399226Z","structure_string":"U2 Tc6\n1.0\n6.001236 0.000000 0.000000\n-3.000619 5.197224 0.000000\n0.000000 0.000000 4.252864\nU Tc\n2 6\ndirect\n0.333333 0.666666 0.750000 U\n0.666665 0.333331 0.250001 U\n0.171430 0.342861 0.250001 Tc\n0.657140 0.828569 0.250001 Tc\n0.171429 0.828569 0.250001 Tc\n0.828569 0.657139 0.750000 Tc\n0.342861 0.171430 0.750000 Tc\n0.828570 0.171430 0.750000 Tc\n","nsites":8,"nelements":2,"elements":["U","Tc"],"chemical_system":"Tc-U","density":13.320504980809392,"density_atomic":0.06031097521857365,"volume":132.64584051256202,"volume_molar":9.985149034939488,"formula_full":"U2 Tc6","formula_reduced":"UTc3","formula_anonymous":"AB3","energy":-84.44229326,"energy_per_atom":-10.5552866575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-84.44229326,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.56e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:34.525000Z","spacegroup":194},{"id":"mp-1206509","created_at":"2022-09-04T14:46:33.934234Z","structure_string":"U4 Tc2\n1.0\n0.000000 3.047556 0.000000\n0.271558 0.000000 4.906835\n7.534557 -1.523778 -0.406930\nU Tc\n4 2\ndirect\n0.168646 0.500218 0.337292 U\n0.831354 0.499782 0.662708 U\n0.500000 0.500000 0.000000 U\n0.000000 0.000000 0.000000 U\n0.324420 0.999659 0.648841 Tc\n0.675580 0.000341 0.351159 Tc\n","nsites":6,"nelements":2,"elements":["U","Tc"],"chemical_system":"Tc-U","density":16.870490008332055,"density_atomic":0.05309384979136358,"volume":113.00743915872494,"volume_molar":11.342445092349626,"formula_full":"U4 Tc2","formula_reduced":"U2Tc","formula_anonymous":"AB2","energy":-65.64998638,"energy_per_atom":-10.941664396666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-65.64998638,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.2255988,"is_theoretical":true,"updated_at":"2021-11-28T01:37:31.763000Z","spacegroup":65},{"id":"mp-2540","created_at":"2022-09-04T14:46:13.421282Z","structure_string":"V1 Tc1\n1.0\n3.025957 0.000000 0.000000\n0.000000 3.025957 0.000000\n0.000000 0.000000 3.025957\nV Tc\n1 1\ndirect\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Tc\n","nsites":2,"nelements":2,"elements":["V","Tc"],"chemical_system":"Tc-V","density":8.926404522114195,"density_atomic":0.07218413206721991,"volume":27.706920381581142,"volume_molar":8.342748728199727,"formula_full":"V1 Tc1","formula_reduced":"VTc","formula_anonymous":"AB","energy":-20.18935392,"energy_per_atom":-10.09467696,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-20.18935392,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0011586,"is_theoretical":false,"updated_at":"2021-11-28T01:37:25.306000Z","spacegroup":221},{"id":"mp-1096530","created_at":"2022-09-04T14:44:15.561819Z","structure_string":"V1 Tc2 W1\n1.0\n-4.651855 5.363245 7.561738\n4.651855 -5.363245 7.561738\n4.651855 5.363245 -7.561738\nV Tc W\n1 2 1\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.251059 0.251059 Tc\n0.000000 0.748941 0.748941 Tc\n0.000000 0.500000 0.500000 W\n","nsites":4,"nelements":3,"elements":["V","Tc","W"],"chemical_system":"Tc-V-W","density":0.9479178878908125,"density_atomic":0.00530059434007552,"volume":754.6323569335831,"volume_molar":113.61255688761499,"formula_full":"V1 Tc2 W1","formula_reduced":"VTc2W","formula_anonymous":"ABC2","energy":-26.21804368,"energy_per_atom":-6.55451092,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.21804368,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0,"is_theoretical":true,"updated_at":"2021-11-28T01:36:30.955000Z","spacegroup":71},{"id":"mp-1095739","created_at":"2022-09-04T14:41:36.436007Z","structure_string":"V2 Tc1 W1\n1.0\n-4.469869 5.187840 7.336911\n4.469869 -5.187840 7.336911\n4.469869 5.187840 -7.336911\nV Tc W\n2 1 1\ndirect\n0.000000 0.249194 0.249194 V\n0.000000 0.750806 0.750806 V\n0.000000 0.000000 0.000000 Tc\n0.000000 0.500000 0.500000 W\n","nsites":4,"nelements":3,"elements":["V","Tc","W"],"chemical_system":"Tc-V-W","density":0.93629416683113,"density_atomic":0.005877672453694495,"volume":680.5414952113813,"volume_molar":102.4579169295951,"formula_full":"V2 Tc1 W1","formula_reduced":"V2TcW","formula_anonymous":"ABC2","energy":-24.35741673,"energy_per_atom":-6.0893541825,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-24.35741673,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.9067342,"is_theoretical":true,"updated_at":"2021-11-28T01:35:25.980000Z","spacegroup":71}]}