material_id stringlengths 4 10 | formula stringlengths 1 25 | space_group_number int64 1 230 | crystal_system stringclasses 7
values | structure stringlengths 533 242k | deprecated bool 2
classes | uncorrected_energy_per_atom float64 -86.36 -0.03 ⌀ | energy_per_atom float64 -86.36 -0.03 ⌀ | formation_energy_per_atom float64 -5.15 8.99 ⌀ | energy_above_hull float64 -0 9.71 ⌀ | is_stable bool 2
classes | equilibrium_reaction_energy_per_atom float64 -4.52 0 ⌀ | band_gap float64 0 17.9 ⌀ | cbm float64 -9.83 14.7 ⌀ | vbm float64 -14.22 14.7 ⌀ | efermi float64 -14.02 19.4 ⌀ | is_gap_direct bool 2
classes | is_metal bool 2
classes | is_magnetic bool 2
classes | ordering stringclasses 5
values | total_magnetization float64 0 320 ⌀ | total_magnetization_normalized_vol float64 0 0.26 ⌀ | total_magnetization_normalized_formula_units float64 0 214 ⌀ | num_magnetic_sites int64 0 160 ⌀ | num_unique_magnetic_sites int64 0 160 ⌀ | possible_species listlengths 0 10 ⌀ | theoretical bool 2
classes | e_total float64 1.16 127k ⌀ | e_ionic float64 0 127k ⌀ | e_electronic float64 -64.84 46.9k ⌀ | n float64 0 216 ⌀ | universal_anisotropy float64 -8,421,341,618,307,863,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000 2,889,475,335,111,887,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000,000B ⌀ | homogeneous_poisson float64 -179.36 82.9 ⌀ | e_ij_max float64 0 119 ⌀ | xas_is_available bool 2
classes | bandstructure_is_available bool 2
classes | dos_is_available bool 2
classes | decomposes_to_is_available bool 2
classes | types_of_magnetic_species_is_available bool 2
classes |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
mp-1219104 | SmCoSi4 | 191 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.11408,-3.661695,0.0],[-2.117928,3.663917,0.0],[0.0,0.0,-6.355224]],"pbc":[true,true,true],"a":4.228160890910491,"b":4.232009782133425,"c":6.355224,"alpha":90.0,"beta":90.0,"gamma":119.96993824319297,"volume":98.5124544512629... | false | -5.846508 | -5.799175 | -0.206962 | 0.312329 | false | null | 0 | null | null | 7.739826 | false | true | false | NM | 0.001135 | 0.000012 | 0.001135 | 0 | 0 | [
"Co+",
"Sm3+",
"Si-"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219105 | SmAl3Cu | 107 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.08768593,2.08768593,5.29994657],[2.08768593,-2.08768593,5.29994657],[2.08768593,2.08768593,-5.29994657]],"pbc":[true,true,true],"a":6.06681949043275,"b":6.06681949043275,"c":6.06681949043275,"alpha":139.74439001764753,"beta"... | false | -12.672005 | -12.672005 | -0.516802 | 0 | true | -0.035375 | 0 | null | null | 6.305588 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219106 | SmY(MnGe)4 | 123 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.967853,0.0,0.0],[0.0,3.967853,0.0],[0.0,0.0,10.873821]],"pbc":[true,true,true],"a":3.967853,"b":3.967853,"c":10.873821,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":171.19588753908835},"properties":{"magmom":null,"charge":nu... | false | -7.116231 | -7.116231 | -0.479446 | 0 | true | -0.000088 | 0 | null | null | 5.734829 | false | true | true | FiM | 7.714093 | 0.04506 | 7.714093 | 5 | 2 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219107 | SmCdIn | 164 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.43353802,-4.21501051,0.0],[2.43353802,4.21501051,-0.0],[-0.0,-0.0,7.64239093]],"pbc":[true,true,true],"a":4.867075188878427,"b":4.867075188878427,"c":7.64239093,"alpha":90.0,"beta":90.0,"gamma":119.99998843047427,"volume":156... | false | -24.685899 | -3.214068 | -0.401478 | 0 | true | -0.004794 | 0 | null | null | 4.694567 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219108 | SmAlCu | 74 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.755837,2.764285,3.808652],[2.755837,-2.764285,3.808652],[2.755837,2.764285,-3.808652]],"pbc":[true,true,true],"a":5.453598737429992,"b":5.453598737429992,"c":5.453598737429992,"alpha":119.2942098150896,"beta":119.08839493713... | false | -4.537916 | -16.154622 | -0.384016 | 0.059597 | false | null | 0 | null | null | 5.476564 | false | true | false | NM | 0.00011 | 0.000001 | 0.000055 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219109 | SmEr(Co2Ni3)2 | 47 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.957705,0.0,0.0],[0.0,4.891199,0.0],[0.0,0.0,8.415202]],"pbc":[true,true,true],"a":3.957705,"b":4.891199,"c":8.415202,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":162.90083014314555},"properties":{"magmom":null,"charge":null... | false | -6.207979 | -6.207979 | -0.166246 | 0.096518 | false | null | 0 | 5.5393 | 5.5911 | 5.556476 | false | true | true | FiM | 7.8193 | 0.048 | 7.8193 | 12 | 7 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219110 | SmAlZn | 12 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.25514216,5.27588363,-0.00132984],[-2.25514216,5.27588363,-0.00132984],[-0.0,5.05246902,5.38066391]],"pbc":[true,true,true],"a":5.737648996547791,"b":5.737648996547791,"c":7.38098823399931,"alpha":51.004061640144,"beta":51.004... | false | -15.622816 | -3.689718 | -0.448416 | 0 | true | -0.001955 | 0 | null | null | 4.223449 | false | true | true | FM | 0.408547 | 0.00319 | 0.204274 | 2 | 1 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219111 | SmGd(MnNi4)2 | 25 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,0.0,-3.939513],[-2.494145,-4.32118,0.0],[-7.481059,4.320386,0.0]],"pbc":[true,true,true],"a":3.939513,"b":4.989324190050692,"c":8.638980203153437,"alpha":90.01371780082867,"beta":90.0,"gamma":90.0,"volume":169.8035353770815... | false | -7.183943 | -7.183943 | -0.23729 | 0.043374 | false | null | 0 | null | null | 5.970124 | false | true | true | FiM | 15.866558 | 0.093441 | 15.866558 | 12 | 10 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219112 | SmB4(IrOs)2 | 77 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,0.0,4.009435],[7.611137,0.0,0.0],[0.0,7.611137,0.0]],"pbc":[true,true,true],"a":4.009435,"b":7.611137,"c":7.611137,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":232.26418968076916},"properties":{"magmom":null,"charge":null... | false | -8.445034 | -8.445034 | -0.493061 | 0.024087 | false | null | 0 | null | null | 7.311992 | false | true | false | NM | 0.012848 | 0.000055 | 0.006424 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219113 | SmBiS3 | 62 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.0460441,-0.0,0.0],[-0.0,10.90302464,0.0],[0.0,0.0,11.01537037]],"pbc":[true,true,true],"a":4.0460441,"b":10.90302464,"c":11.01537037,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":485.9333540089203},"properties":{"magmom":nul... | false | -23.854823 | -5.698498 | -1.494335 | 0.010728 | false | null | 1.6508 | 5.8263 | 4.1755 | 5.826215 | false | false | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Sm3+",
"S2-",
"Bi3+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219114 | Sn9Au4 | 8 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[7.663221,5.501913,0.0],[-7.663221,5.501913,0.0],[0.0,5.391904,7.628185]],"pbc":[true,true,true],"a":9.433769276085249,"b":9.433769276085249,"c":9.34140434514217,"alpha":70.32804647637377,"beta":70.32804647637377,"gamma":108.646... | false | -3.736462 | -32.615449 | 0.081128 | 0.169462 | false | null | 0 | null | null | 7.348263 | false | true | false | NM | 0.001416 | 0.000002 | 0.000708 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219115 | SmAlCu4 | 187 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.636558,-4.566651999999999,0.0],[2.636558,4.566651999999999,0.0],[0.0,0.0,3.9959249999999993]],"pbc":[true,true,true],"a":5.273115642243017,"b":5.273115642243017,"c":3.9959249999999993,"alpha":90.0,"beta":90.0,"gamma":119.9999... | false | -4.379449 | -13.608775 | -0.300074 | 0.014117 | false | null | 0 | null | null | 5.733083 | false | true | false | NM | 0.001357 | 0.000014 | 0.001357 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219116 | SmHo3Ni4 | 6 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.176357,0.0,0.0],[0.0,5.442166,0.0],[0.0,2.507155,21.179014]],"pbc":[true,true,true],"a":4.176357,"b":5.442166,"c":21.32689523128533,"alpha":83.24879008269437,"beta":90.0,"gamma":90.0,"volume":481.3656962768929},"properties":{... | false | -5.638327 | -5.638327 | -0.434306 | 0.003174 | false | null | 0 | null | null | 4.594815 | false | true | false | NM | 0.000914 | 0.000002 | 0.000305 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219117 | SmFeCu | 38 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.647455,-4.542281,0.0],[-5.25746,-0.021608,0.0],[0.0,0.0,-8.732797]],"pbc":[true,true,true],"a":5.257502701852468,"b":5.2575044039224546,"c":8.732797,"alpha":90.0,"beta":90.0,"gamma":59.528873637388024,"volume":208.0471381852... | false | -5.774114 | -5.774114 | -0.011509 | 0.127205 | false | null | 0 | null | null | 4.871568 | false | true | true | FiM | 6.38179 | 0.030675 | 1.595448 | 8 | 5 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219118 | Sr18Co14O45 | 5 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.788191,8.871585,0.0],[-4.788191,8.871585,0.0],[0.0,0.588598,11.848479]],"pbc":[true,true,true],"a":10.081259517773857,"b":10.081259517773857,"c":11.863089910265579,"alpha":87.49753447960694,"beta":87.49753447960694,"gamma":56... | false | -6.035812 | -6.735123 | -2.15084 | 0.012963 | false | null | 0.3754 | 2.6637 | 2.2883 | 2.663608 | false | false | true | FM | 12.002682 | 0.011924 | 12.002682 | 14 | 7 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219120 | SmH18(BrO6)3 | 186 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.978302,-10.354722,0.0],[5.978302,10.354722,0.0],[0.0,0.0,6.809432]],"pbc":[true,true,true],"a":11.956603301125618,"b":11.956603301125618,"c":6.809432,"alpha":90.0,"beta":90.0,"gamma":119.99999613291867,"volume":843.0574618442... | false | -4.879553 | -5.188703 | -1.19356 | 0 | true | -0.047177 | 4.4536 | 3.1784 | -1.2752 | 3.178403 | false | false | false | NM | 0.001889 | 0.000002 | 0.000944 | 0 | 0 | [
"H+",
"Sm3+",
"Br5+",
"O2-"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219121 | SmEr3Mn8 | 156 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.528486,-4.350934,-0.015123],[-2.528486,4.350934,0.015123],[0.0,-0.028742999999999002,-8.638031]],"pbc":[true,true,true],"a":5.03230531960065,"b":5.03230531960065,"c":8.638078820953766,"alpha":90.33702169450979,"beta":89.6629... | false | -7.523649 | -20.718214 | 0.029779 | 0.126754 | false | null | 0 | null | null | 4.790709 | false | true | true | FiM | 1.89309 | 0.009961 | 1.89309 | 10 | 10 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219122 | RbV3Cd4O12 | 9 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[6.880856,6.648865,0.0],[-6.880856,6.648865,0.0],[0.0,3.045228,6.520711]],"pbc":[true,true,true],"a":9.568363761948069,"b":9.568363761948069,"c":7.196741312393062,"alpha":72.90053308904878,"beta":72.90053308904878,"gamma":91.964... | false | -5.929234 | -6.596434 | -2.024043 | 0 | true | -0.004187 | 2.3178 | 2.492 | 0.1742 | 2.492086 | false | false | false | NM | 0.000049 | 0 | 0.000025 | 0 | 0 | [
"Cd2+",
"V5+",
"Rb+",
"O2-"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219123 | SmAlFe | 38 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.7496929999999993,-4.662458,0.0],[2.7496929999999993,4.662458,0.0],[0.0,0.0,8.849828]],"pbc":[true,true,true],"a":5.412885200705165,"b":5.412885200705165,"c":8.849828,"alpha":90.0,"beta":90.0,"gamma":118.93989011773168,"volume... | false | -5.865146 | -5.865146 | -0.220418 | 0.054793 | false | null | 0 | 4.9296 | 4.9644 | 4.938494 | false | true | true | FiM | 6.846969 | 0.030174 | 1.711742 | 8 | 5 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219124 | Sr14GaAs11 | 45 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-8.28373952,8.27876777,-11.11454558],[8.28373952,-8.27876777,-11.11454558],[-8.28373952,-8.27876777,-11.11454558]],"pbc":[true,true,true],"a":16.145942514288166,"b":16.145942514288166,"c":16.145942514288166,"alpha":61.734933046... | false | -16.124031 | -16.124031 | -1.306151 | 0 | true | -0.013858 | 0 | null | null | 2.697393 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [
"As3-",
"Ga3+",
"Sr2+",
"As2-"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219125 | Sm7Ti4(Se2O)6 | 8 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[1.909759,14.130018,0.0],[-1.909759,14.130018,0.0],[0.0,0.08246099999999901,11.198727]],"pbc":[true,true,true],"a":14.258491789751291,"b":14.258491789751291,"c":11.199030593629521,"alpha":89.58191577833776,"beta":89.581915778337... | false | -6.868145 | -7.205593 | -2.507291 | 0.026561 | false | null | 0 | null | null | 4.198328 | false | true | true | FM | 0.619078 | 0.001024 | 0.619078 | 2 | 4 | [
"O2-",
"Se2-",
"Ti3+",
"Sm3+",
"Ti4+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219126 | SmFe2Ni2B | 35 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.535066999999999,-4.362025,0.0],[2.535066999999999,4.362025,0.0],[0.0,0.0,7.049933]],"pbc":[true,true,true],"a":5.045178569199905,"b":5.045178569199905,"c":7.049933,"alpha":90.0,"beta":90.0,"gamma":119.67247866373852,"volume":... | false | -6.917237 | -6.917237 | -0.267521 | 0.067793 | false | null | 0 | 5.5282 | 5.5777 | 5.574817 | false | true | true | FiM | 5.758879 | 0.036936 | 2.87944 | 8 | 7 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219127 | Re3HgO9 | 183 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.719872,-6.443008,0.0],[3.719872,6.443008,0.0],[0.0,0.0,3.789363]],"pbc":[true,true,true],"a":7.439744604786377,"b":7.439744604786377,"c":3.789363,"alpha":90.0,"beta":90.0,"gamma":120.00000537818786,"volume":181.64057694843802... | false | -7.731084 | -8.2067 | -1.884726 | 0.085572 | false | null | 0 | 2.3013 | 2.3367 | 2.313316 | false | true | false | NM | 0.097891 | 0.000539 | 0.097891 | 0 | 0 | [
"Hg2+",
"O2-",
"Re5.33+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219128 | Sr2Ca2NdMn5O15 | 1 | Triclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.489681,0.0,0.0],[-2.36557,9.072261,0.0],[-2.630757,-2.296344,11.494542]],"pbc":[true,true,true],"a":5.489681,"b":9.375598171691287,"c":12.013266581123927,"alpha":97.45301555159003,"beta":102.6495796910741,"gamma":104.61432929... | false | -7.123031 | -7.868831 | -2.581083 | 0.029822 | false | null | 0 | null | null | 3.319916 | false | true | true | FM | 31.996701 | 0.055892 | 15.99835 | 10 | 10 | [
"Nd3+",
"O2-",
"Sr2+",
"Mn3+",
"Mn4+",
"Ca2+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219129 | SmErFe17C2 | 8 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-4.312154,2.463089,4.154938],[-0.022979,-4.965979,4.154938],[4.338247,2.504688,4.156868]],"pbc":[true,true,true],"a":6.474950912978491,"b":6.47495059801432,"c":6.509485431259294,"alpha":83.55163808036993,"beta":83.5516426437099... | false | -8.227231 | -8.227231 | -0.049201 | 0.022584 | false | null | 0 | null | null | 4.936913 | false | true | true | FiM | 36.087281 | 0.134756 | 36.087281 | 19 | 13 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219130 | SmGaCo2 | 164 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.632415,-4.557475,-0.000368999999999],[-5.26483,0.0,0.0],[0.0,-0.001323999999999,-16.464378]],"pbc":[true,true,true],"a":5.263096735194119,"b":5.26483,"c":16.464378053235414,"alpha":90.0,"beta":89.99199317280726,"gamma":59.98... | false | -5.725482 | -5.725482 | -0.222103 | 0.090415 | false | null | 0 | null | null | 4.534748 | false | true | true | FiM | 13.003906 | 0.032917 | 2.167318 | 16 | 9 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219131 | Re2Si8MoW | 99 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.207075,0.0,0.0],[0.0,3.207075,0.0],[0.0,0.0,15.753259]],"pbc":[true,true,true],"a":3.207075,"b":3.207075,"c":15.753259,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":162.02746826674505},"properties":{"magmom":null,"charge":nu... | false | -8.012291 | -7.964957 | -0.289745 | 0.093863 | false | null | 0 | 10.9533 | 10.9848 | 10.980136 | false | true | false | NM | 0.013643 | 0.000084 | 0.013643 | 0 | 0 | [
"Re3+",
"Si2-",
"Mo6+",
"W4+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219132 | Re2MoSe4 | 1 | Triclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[6.73160724,-0.01017984,-0.00627332],[-0.42820791,6.71583158,0.00819322],[-0.43039855,-0.41759208000000003,6.70722941]],"pbc":[true,true,true],"a":6.731617860314611,"b":6.729474195950663,"c":6.733984883818033,"alpha":93.24509119... | false | -27.430227 | -27.430227 | -0.553163 | 0 | true | -0.033262 | 1.0564 | 5.3215 | 4.2651 | 5.321242 | false | false | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Re3+",
"Se2-",
"Mo2+"
] | true | 13.729222 | 0.431006 | 13.298216 | 3.646672 | null | null | 0.079296 | false | false | false | false | true |
mp-1219133 | SmAlNi | 38 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.751883,-4.7672930000000004,0.0],[-2.607665,4.684031,0.0],[0.0,0.0,-8.739345]],"pbc":[true,true,true],"a":5.504538363345105,"b":5.360975952304393,"c":8.739345,"alpha":90.0,"beta":90.0,"gamma":120.89934846804368,"volume":221.2... | false | -5.203689 | -5.203689 | -0.455589 | 0.076986 | false | null | 0 | null | null | 5.805178 | false | true | false | NM | 0.002374 | 0.000011 | 0.000593 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219134 | SmNi3Sn2 | 189 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,0.0,-4.265179],[-9.338097,0.002137,0.0],[-4.670899,8.085961,0.0]],"pbc":[true,true,true],"a":4.265179,"b":9.338097244523532,"c":9.338097384463389,"alpha":59.9737778973889,"beta":90.0,"gamma":90.0,"volume":322.0103790418089}... | false | -5.465742 | -5.465742 | -0.452719 | 0.003516 | false | null | 0 | null | null | 7.695962 | false | true | false | NM | 0.010961 | 0.000034 | 0.003654 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219135 | Re3Mo | 187 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[1.392047,-2.411097,0.0],[1.392047,2.411097,0.0],[0.0,0.0,9.130566]],"pbc":[true,true,true],"a":2.7840947529884823,"b":2.7840947529884823,"c":9.130566,"alpha":90.0,"beta":90.0,"gamma":120.00001789354143,"volume":61.2909393098185... | false | -11.927617 | -45.7226 | 0.103356 | 0.129722 | false | null | 0 | null | null | 7.347613 | false | true | false | NM | 0.002992 | 0.000049 | 0.002992 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219136 | Sm3DyS4 | 47 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.97016664,-0.0,0.0],[0.0,5.62869828,0.0],[0.0,0.0,7.96365533]],"pbc":[true,true,true],"a":3.97016664,"b":5.62869828,"c":7.96365533,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":177.96277148235689},"properties":{"magmom":null,... | false | -21.440099 | -6.673995 | -2.258529 | 0.00566 | false | null | 0 | null | null | 6.216549 | false | true | false | NM | 0.000001 | 0 | 0.000001 | 0 | 0 | [
"Sm2+",
"S2-",
"Dy2+"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219137 | Sm2Ga3Cu | 25 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.78098103,0.0,0.0],[0.0,4.35469074,0.0],[0.0,0.0,7.55013279]],"pbc":[true,true,true],"a":3.78098103,"b":4.35469074,"c":7.55013279,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":124.31295963765672},"properties":{"magmom":null,"... | false | -18.100475 | -18.100475 | -0.660313 | 0.005629 | false | null | 0 | null | null | 3.767725 | false | true | false | NM | 0.000003 | 0 | 0.000003 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219138 | Re2Ni(MoS4)2 | 44 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-3.386489,3.442352,4.823727],[3.386489,-3.442352,4.823727],[3.386489,3.442352,-4.823727]],"pbc":[true,true,true],"a":6.825425789615913,"b":6.825425789615913,"c":6.825425789615913,"alpha":120.50773339117674,"beta":119.4245744140... | false | -7.166057 | -7.475595 | -0.901222 | 0.076986 | false | null | 0 | 6.2268 | 6.2686 | 6.255222 | false | true | true | FM | 1.999931 | 0.008891 | 1.999931 | 3 | 2 | [
"Re3+",
"Mo4+",
"S2-",
"Ni2+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219139 | SmEr3Fe34 | 187 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,0.0,-8.263686],[-8.433022,0.0,0.0],[-4.216511,7.300065,0.0]],"pbc":[true,true,true],"a":8.263686,"b":8.433022,"c":8.4302973860562,"alpha":59.98930828231127,"beta":90.0,"gamma":90.0,"volume":508.7258043353511},"properties":{... | false | -8.069166 | -8.069166 | -0.005943 | 0.025415 | false | null | 0 | null | null | 4.632086 | false | true | true | FiM | 75.461458 | 0.148334 | 75.461458 | 38 | 18 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219140 | Sm3YS4 | 12 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[1.9912786900000001,6.58475745,-0.03659929],[-1.9912786900000001,6.58475745,-0.03659929],[0.0,1.25128396,6.7905611]],"pbc":[true,true,true],"a":6.879357601157765,"b":6.879357601157765,"c":6.904884618977097,"alpha":80.31538277611... | false | -19.987032 | -6.909461 | -2.257656 | 0.003637 | false | null | 0 | null | null | 6.164521 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219141 | SmAlNi | 38 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.680811,-4.707689,0.0],[-2.735006,4.738991,0.0],[0.0,0.0,-8.51981]],"pbc":[true,true,true],"a":5.417479426674549,"b":5.471589670115716,"c":8.51981,"alpha":90.0,"beta":90.0,"gamma":120.35002727805833,"volume":217.9358610909502... | false | -5.205286 | -5.205286 | -0.457187 | 0.075389 | false | null | 0 | null | null | 5.925215 | false | true | false | NM | 0.000732 | 0.000003 | 0.000183 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219142 | Sc3Ga5Ni | 5 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,0.0,-6.815754],[-3.973572,5.876606,-3.407877],[3.975319,5.877809,3.407877]],"pbc":[true,true,true],"a":6.815754,"b":7.870031649590044,"c":7.871812081050398,"alpha":83.38956579545571,"beta":115.65311173270351,"gamma":64.3406... | false | -4.966293 | -4.966293 | -0.530957 | 0.090516 | false | null | 0 | null | null | 4.742404 | false | true | false | NM | 0.003406 | 0.000011 | 0.001703 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219143 | Sm6Mn(SiS7)2 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[10.080839448694329,0.000011739954800800002,1.1501902093e-6],[-5.040412004185007,8.730271754420803,-1.6553715309e-6],[6.446576925e-7,-7.046633209e-7,5.6719342857891535]],"pbc":[true,true,true],"a":10.08083944870123,"b":10.080843... | false | -15.944375 | -6.529349 | -1.909882 | 0 | true | -0.037058 | 1.5909 | 5.9941 | 4.4032 | 4.403224 | false | false | true | FM | 4.99995 | 0.010016 | 4.99995 | 1 | 1 | [
"Sm3+",
"Mn2+",
"Si4+",
"S2-"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219144 | Sm2AsSe | 166 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[6.961946109999999,-2.09339891,0.0007193400000000001],[6.961946109999999,2.09339891,0.0007193400000000001],[6.3321100900000005,0.0,3.5714698400000002]],"pbc":[true,true,true],"a":7.269870229404603,"b":7.269870229404603,"c":7.269... | false | -24.128885 | -24.128885 | -2.00765 | 0.000186 | false | null | 0 | null | null | 4.856316 | false | true | false | NM | 0.000001 | 0 | 0.000001 | 0 | 0 | [
"Sm2+",
"Se2-",
"As2-"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219145 | Re(Te2Mo)2 | 1 | Triclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[7.106992,0.0,0.0],[-0.350823,7.142201,0.0],[-0.349323,-0.385434,7.150136]],"pbc":[true,true,true],"a":7.106992,"b":7.150811974994867,"c":7.169032762177963,"alpha":92.94104832154126,"beta":92.79293774289414,"gamma":92.8120931715... | false | -6.898093 | -7.139236 | -0.466002 | 0.016234 | false | null | 0 | null | null | 6.211006 | false | true | false | NM | 0.000094 | 0 | 0.000047 | 0 | 0 | [
"Re3+",
"Mo2.50+",
"Te2-"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219146 | SmFe10Mo2N | 71 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.251796,4.309645,4.711647],[2.251796,-4.309645,4.711647],[2.251796,4.309645,-4.711647]],"pbc":[true,true,true],"a":6.770763819854449,"b":6.770763819854449,"c":6.770763819854449,"alpha":141.14955001301277,"beta":100.9361674970... | false | -8.367422 | -8.393207 | 0.138819 | 0.376932 | false | null | 0 | 5.4599 | 5.5032 | 5.480265 | false | true | true | FiM | 19.06356 | 0.104232 | 19.06356 | 13 | 6 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219147 | Sm6Cd(SiS7)2 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.088729,-8.813937,0.0],[5.088729,8.813937,0.0],[0.0,0.0,5.680682]],"pbc":[true,true,true],"a":10.177457849355603,"b":10.177457849355603,"c":5.680682,"alpha":90.0,"beta":90.0,"gamma":119.99999902072274,"volume":509.576907999606... | false | -5.848589 | -6.154763 | -1.891905 | 0 | true | -0.009529 | 1.8741 | 5.6073 | 3.7332 | 3.733367 | false | false | false | NM | 0.003782 | 0.000007 | 0.003782 | 0 | 0 | [
"Cd2+",
"Sm3+",
"S2-",
"Si4+"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219148 | Sm4Ti4S4O9 | 8 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[1.852266999999999,9.070508,0.0],[-1.852266999999999,9.070508,0.0],[0.0,8.846119,9.25079]],"pbc":[true,true,true],"a":9.257699952869126,"b":9.257699952869126,"c":12.799645971129866,"alpha":47.37885515628916,"beta":47.37885515628... | false | -8.134414 | -8.524652 | -3.21334 | 0.014352 | false | null | 0 | null | null | 5.813638 | false | true | true | FM | 0.588292 | 0.001893 | 0.588292 | 2 | 4 | [
"O2-",
"S2-",
"Ti3+",
"Sm3+",
"Ti4+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219149 | Sm6Mg(GeS7)2 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.048616,-8.74446,0.0],[5.048616,8.74446,0.0],[0.0,0.0,5.807872]],"pbc":[true,true,true],"a":10.097232502376876,"b":10.097232502376876,"c":5.807872,"alpha":90.0,"beta":90.0,"gamma":120.0000032916927,"volume":512.8051367323629},... | false | -5.800592 | -6.106766 | -1.884522 | 0 | true | -0.019335 | 2.0667 | 5.5911 | 3.5244 | 3.524374 | false | false | false | NM | 0.000031 | 0 | 0.000031 | 0 | 0 | [
"Mg2+",
"Sm3+",
"S2-",
"Ge4+"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219150 | SmIn7Cu5 | 44 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.801746999999999,4.730878,4.735494],[2.801746999999999,-4.730878,4.735494],[2.801746999999999,4.730878,-4.735494]],"pbc":[true,true,true],"a":7.256438267285748,"b":7.256438267285748,"c":7.256438267285748,"alpha":134.575287346... | false | -3.510604 | -18.767465 | -0.15077 | 0.052845 | false | null | 0 | 7.9943 | 8.0435 | 8.042418 | false | true | false | NM | 0.000007 | 0 | 0.000007 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219151 | Sm4Ga7Ag5 | 6 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.39809959,0.0,0.0],[0.0,7.06322091,-0.00085646],[0.0,0.04094594,10.28105927]],"pbc":[true,true,true],"a":4.39809959,"b":7.063220961925584,"c":10.281140806508557,"alpha":89.77875920218855,"beta":90.0,"gamma":90.0,"volume":319.3... | false | -19.652105 | -19.652105 | -0.538948 | 0.027039 | false | null | 0 | 3.7618 | 3.7922 | 3.781643 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219152 | Re2NiO6 | 136 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.762812999999999,0.0,0.0],[0.0,4.762812999999999,0.0],[0.0,0.0,8.487147]],"pbc":[true,true,true],"a":4.762812999999999,"b":4.762812999999999,"c":8.487147,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":192.52573278547572},"prop... | false | -7.751864 | -8.492197 | -1.785071 | 0.112252 | false | null | 0 | null | null | 4.976718 | false | true | true | FM | 3.800939 | 0.019742 | 1.900469 | 2 | 1 | [
"Re5+",
"O2-",
"Ni2+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219153 | RbTlP2(HO2)4 | 4 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.606808,0.0,0.0],[0.0,6.568665,0.0],[0.0,0.460371,14.495829]],"pbc":[true,true,true],"a":4.606808,"b":6.568665,"c":14.50313758656664,"alpha":88.18096278602049,"beta":90.0,"gamma":90.0,"volume":438.6521709613362},"properties":{... | false | -5.917107 | -6.260607 | -2.0514 | 0.004796 | false | null | 4.6684 | 4.688 | 0.0196 | 0.019628 | true | false | false | NM | 0.000375 | 0.000001 | 0.000187 | 0 | 0 | [
"O2-",
"H+",
"Rb+",
"P5+",
"Tl+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219154 | Sm2ScNbO7 | 74 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-3.704606,3.77083,5.2767],[3.704606,-3.77083,5.2767],[3.704606,3.77083,-5.2767]],"pbc":[true,true,true],"a":7.46905799911448,"b":7.46905799911448,"c":7.46905799911448,"alpha":120.5294001073521,"beta":119.35585691163841,"gamma":... | false | -8.742818 | -9.18 | -3.679394 | 0.032796 | false | null | 2.51 | 4.9874 | 2.4774 | 2.451613 | true | false | false | NM | 0.0009 | 0.000003 | 0.00045 | 0 | 0 | [
"Nb5+",
"O2-",
"Sm3+",
"Sc3+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219155 | SmYCo6 | 160 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.49948416745731,-4.329233570750057,0.0],[2.49948416745731,4.329233570750057,0.0],[0.0,0.0,49.516308320000014]],"pbc":[true,true,true],"a":4.998968334914621,"b":4.998968334914621,"c":49.516308320000014,"alpha":90.0,"beta":90.0,... | true | null | null | null | null | false | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | true | null | null | null | null | null | null | null | false | false | false | false | false |
mp-1219156 | Sm4Cu5P7 | 121 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.678442,2.678442,9.848221],[2.678442,-2.678442,9.848221],[2.678442,2.678442,-9.848221]],"pbc":[true,true,true],"a":10.551566706398107,"b":10.551566706398107,"c":10.551566706398107,"alpha":150.58991609927207,"beta":150.5899160... | false | -5.622708 | -15.687663 | -0.9264 | 0.038412 | false | null | 0 | null | null | 5.951837 | false | true | false | NM | 0.00118 | 0.000004 | 0.00118 | 0 | 0 | [
"P3-",
"Cu+",
"Sm3+",
"Cu2+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219157 | Sm2Si3Ni | 187 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.030087,-3.516215,0.0],[2.030087,3.516215,0.0],[0.0,0.0,8.231313]],"pbc":[true,true,true],"a":4.060175015167942,"b":4.060175015167942,"c":8.231313,"alpha":90.0,"beta":90.0,"gamma":120.0000165418898,"volume":117.51388502912351}... | false | -5.934583 | -5.934583 | -0.685706 | 0.125895 | false | null | 0 | null | null | 5.970809 | false | true | false | NM | 0.083117 | 0.000707 | 0.083117 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219158 | Sm6Cd(GeS7)2 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.066413,-8.775284,0.0],[5.066413,8.775284,0.0],[0.0,0.0,5.806421]],"pbc":[true,true,true],"a":10.13282536942313,"b":10.13282536942313,"c":5.806421,"alpha":90.0,"beta":90.0,"gamma":119.99999588282351,"volume":516.2978152735151}... | false | -5.685645 | -5.991819 | -1.798725 | 0 | true | -0.006954 | 2.0564 | 5.4627 | 3.4063 | 3.406616 | false | false | false | NM | 0.000406 | 0.000001 | 0.000406 | 0 | 0 | [
"Cd2+",
"Sm3+",
"S2-",
"Ge4+"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219159 | Sm6Ge3S14 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.06196133,-8.76754995,-4.53e-6],[5.06196013,8.76753838,-7e-7],[-2.969999999999998e-6,1.249999999999999e-6,5.77051721]],"pbc":[true,true,true],"a":10.123901650657265,"b":10.123891030749151,"c":5.7705172100009,"alpha":90.0000079... | false | -16.14385 | -6.117843 | -1.765488 | 0 | true | -0.005336 | 1.239 | 5.4498 | 4.2108 | 4.210918 | false | false | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Sm2.67+",
"S2-",
"Ge4+"
] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219160 | Sm6Cu8P8O3 | 21 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[2.775672,-13.141026,0.0],[2.775672,13.141026,0.0],[0.0,0.0,5.556831]],"pbc":[true,true,true],"a":13.43096866887344,"b":13.43096866887344,"c":5.556831,"alpha":90.0,"beta":90.0,"gamma":156.14637339441762,"volume":405.372798786875... | false | -6.001932 | -6.084372 | -1.313458 | 0.001275 | false | null | 0 | null | null | 6.544086 | false | true | false | NM | 0.000204 | 0.000001 | 0.000204 | 0 | 0 | [
"O2-",
"Cu2+",
"P3-",
"Sm3+",
"Cu+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219161 | Sm2CuGe4 | 38 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.14620976,0.0,2.538821255588755e-16],[-1.049022106007405e-15,17.13183110000002,1.049022106007405e-15],[0.0,0.0,4.11044711]],"pbc":[true,true,true],"a":4.14620976,"b":17.13183110000002,"c":4.11044711,"alpha":90.0,"beta":90.0,"g... | true | null | null | null | null | false | null | null | null | null | null | null | null | null | null | null | null | null | null | null | null | true | null | null | null | null | null | null | null | false | false | false | false | false |
mp-1219162 | Sm6Ge3Se14 | 143 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.2701398,-9.12798953,0.00010363],[5.27004711,9.12792755,0.000042970000000000004],[0.00008513,-0.00002041,6.06624936]],"pbc":[true,true,true],"a":10.540140719272815,"b":10.54004069733674,"c":6.066249360631666,"alpha":89.9995313... | false | -19.809823 | -5.564589 | -1.602704 | 0.004024 | false | null | 1.1326 | 4.5933 | 3.4607 | 3.467652 | false | false | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Ge3+",
"Se-",
"Se2-",
"Ge2+",
"Sm3+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219163 | Sm2(B2Rh3)3 | 191 | Hexagonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.602203427620912,4.4060230000000014e-9,0.0],[-2.8011022061568682,4.8516500338318505,0.0],[0.0,0.0,8.52290671644995]],"pbc":[true,true,true],"a":5.602203427620912,"b":5.602203282648485,"c":8.52290671644995,"alpha":90.0,"beta":9... | false | -19.56998 | -19.56998 | -0.701155 | 0 | true | -0.050302 | 0 | null | null | 8.435002 | false | true | false | NM | 0.000299 | 0.000001 | 0.000299 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | false | true |
mp-1219164 | Sm2MnRhO6 | 14 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.861034,0.0,0.0],[0.0,5.482026,0.0],[0.0,5.260807,7.590394]],"pbc":[true,true,true],"a":5.861034,"b":5.482026,"c":9.235267801557516,"alpha":55.27465504745352,"beta":90.0,"gamma":90.0,"volume":243.8819458356349},"properties":{"... | false | -7.728637 | -8.307637 | -2.742511 | 0.01754 | false | null | 1.037 | 5.0292 | 3.9922 | 3.996953 | true | false | true | FM | 8.000814 | 0.032806 | 4.000407 | 2 | 1 | [
"Rh3+",
"O2-",
"Sm3+",
"Mn3+"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219165 | Sm4Fe3Co(AsO)4 | 115 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.012169,0.0,0.0],[0.0,4.012169,0.0],[0.0,0.0,18.338289]],"pbc":[true,true,true],"a":4.012169,"b":4.012169,"c":18.338289,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":295.2006087282041},"properties":{"magmom":null,"charge":nul... | false | -6.586925 | -7.28405 | -1.665915 | 0.272064 | false | null | 0 | null | null | 4.102314 | false | true | true | FM | 13.97979 | 0.047357 | 13.97979 | 4 | 4 | [
"O2-",
"Sm3+",
"Fe2+",
"As3-",
"Co2+"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219166 | Sm5B4Rh15 | 123 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.249683,0.0,0.0],[0.0,4.249683,0.0],[0.0,0.0,20.703167]],"pbc":[true,true,true],"a":4.249683,"b":4.249683,"c":20.703167,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":373.89517133445906},"properties":{"magmom":null,"charge":nu... | false | -7.377901 | -7.377901 | -0.678938 | 0.021877 | false | null | 0 | null | null | 5.414777 | false | true | false | NM | 0.101581 | 0.000272 | 0.101581 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219167 | Sm2O3 | 115 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.891828,0.0,0.0],[0.0,3.891828,0.0],[0.0,0.0,5.7136119999999995]],"pbc":[true,true,true],"a":3.891828,"b":3.891828,"c":5.7136119999999995,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":86.5402253134005},"properties":{"magmom":... | false | -8.090145 | -8.502345 | -3.646134 | 0.215818 | false | null | 1.7192 | 3.4417 | 1.7225 | 1.888422 | true | false | false | NM | 0.000002 | 0 | 0.000002 | 0 | 0 | [
"O2-",
"Sm3+"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219168 | Sm2Co16Ge | 160 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-4.191898,2.420193,4.055624],[0.0,-4.840387,4.055624],[4.191898,2.420193,4.055624]],"pbc":[true,true,true],"a":6.314857799588919,"b":6.314858061678426,"c":6.314857799588919,"alpha":83.1829698683077,"beta":83.18297530046284,"gam... | false | -6.808949 | -6.808949 | -0.061851 | 0.054793 | false | null | 0 | null | null | 5.063454 | false | true | true | FiM | 22.135086 | 0.089663 | 22.135086 | 18 | 7 | [] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219169 | Sm2ZnSb4 | 115 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.3421375300000005,0.0,0.0],[0.0,4.3421375300000005,0.0],[0.0,-0.0,10.08156724]],"pbc":[true,true,true],"a":4.3421375300000005,"b":4.3421375300000005,"c":10.08156724,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":190.0794649518... | false | -25.291574 | -4.703765 | -0.816204 | 0 | true | -0.025925 | 0 | null | null | 5.701464 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Sm3+",
"Zn2+",
"Sb2-"
] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219170 | Sm2P3Pt4 | 119 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.07232979,2.07232979,9.47232947],[2.07232979,-2.07232979,9.47232947],[2.07232979,2.07232979,-9.47232947]],"pbc":[true,true,true],"a":9.915348057696884,"b":9.915348057696884,"c":9.915348057696884,"alpha":155.87222719046028,"be... | false | -33.718937 | -6.645744 | -1.09373 | 0.000446 | false | null | 0 | null | null | 6.863469 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219171 | Sm4Si9Ni7 | 5 | Monoclinic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[5.699595,5.534965,0.0],[-5.699595,5.534965,0.0],[0.0,2.860312,4.883786]],"pbc":[true,true,true],"a":7.944886450746165,"b":7.944886450746165,"c":5.65974826570405,"alpha":69.38530460516134,"beta":69.38530460516134,"gamma":91.6790... | false | -6.181367 | -6.149417 | -0.741259 | 0.044476 | false | null | 0 | null | null | 7.478741 | false | true | false | NM | 0.00006 | 0 | 0.00006 | 0 | 0 | [
"Sm2+",
"Ni4+",
"Si4-"
] | true | null | null | null | null | null | null | null | false | false | false | true | true |
mp-1219172 | Sm2SbS | 123 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.277178,0.0,0.0],[0.0,4.277178,0.0],[0.0,0.0,6.040289]],"pbc":[true,true,true],"a":4.277178,"b":4.277178,"c":6.040289,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":110.5025669665764},"properties":{"magmom":null,"charge":null,... | false | -5.929408 | -6.103158 | -1.677265 | 0.093139 | false | null | 0 | null | null | 5.031101 | false | true | false | NM | 0.000032 | 0 | 0.000032 | 0 | 0 | [
"Sm2+",
"Sm3+",
"S2-",
"Sb3-"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219173 | Sm4EuS5 | 166 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[16.348837,-2.021941,0.0],[16.348837,2.021941,0.0],[16.098774,0.0,3.493166]],"pbc":[true,true,true],"a":16.47339420581108,"b":16.47339420581108,"c":16.473394701962068,"alpha":14.100502226289848,"beta":14.100502226289848,"gamma":... | false | -7.026342 | -7.277842 | -2.292897 | 0.004468 | false | null | 0 | 5.9114 | 5.939 | 5.916006 | false | true | true | FM | 7.294203 | 0.031584 | 7.294203 | 1 | 1 | [
"Sm2+",
"Eu2+",
"S2-"
] | true | null | null | null | null | null | null | null | false | false | true | true | true |
mp-1219174 | Sm(ZnGa)2 | 139 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.07232995,2.07232995,5.3451936700000005],[2.07232995,-2.07232995,5.3451936700000005],[2.07232995,2.07232995,-5.3451936700000005]],"pbc":[true,true,true],"a":6.095916519535194,"b":6.095916519535194,"c":6.095916519535194,"alpha... | false | -14.647666 | -3.144612 | -0.485759 | 0 | true | -0.035133 | 0 | null | null | 3.665495 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219175 | Sm2O | 123 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.551176,0.0,0.0],[0.0,3.551176,0.0],[0.0,0.0,4.981717]],"pbc":[true,true,true],"a":3.551176,"b":3.551176,"c":4.981717,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":62.82369072635824},"properties":{"magmom":null,"charge":null,... | false | -6.613427 | -6.842427 | -2.047383 | 0.098146 | false | null | 0 | null | null | 4.376998 | false | true | true | FM | 0.200411 | 0.00319 | 0.200411 | 1 | 2 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219176 | Sm2AsSe | 123 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[4.18353606,0.0,0.0],[0.0,4.18353606,0.0],[0.0,0.0,5.91228626]],"pbc":[true,true,true],"a":4.18353606,"b":4.18353606,"c":5.91228626,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":103.47668019804105},"properties":{"magmom":null,"... | false | -24.121893 | -24.121893 | -2.000658 | 0.007178 | false | null | 0 | null | null | 4.164072 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Sm2+",
"Sm3+",
"Se2-",
"As3-"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219177 | Sm2C | 166 | Trigonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.58440909,-2.58440909,0.0],[0.0,2.58440909,-2.58440909],[2.87157251,-2.87157251,-5.45598161]],"pbc":[true,true,true],"a":3.654906385798309,"b":3.654906385798309,"c":6.801440486325937,"alpha":74.4138969398858,"beta":90.0,"gamm... | false | -23.428502 | -23.428502 | -0.290807 | 0 | true | -0.092293 | 0 | null | null | 3.214809 | false | true | false | NM | 0.003049 | 0.000041 | 0.003049 | 0 | 0 | [
"Sm2+",
"C4-"
] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219178 | Sm3ErS4 | 47 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.95479819,0.0,0.0],[0.0,5.61622597,0.0],[0.0,0.0,7.95391596]],"pbc":[true,true,true],"a":3.95479819,"b":5.61622597,"c":7.95391596,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":176.66474793663286},"properties":{"magmom":null,"... | false | -21.667727 | -6.656949 | -2.247816 | 0.007911 | false | null | 0 | null | null | 6.247135 | false | true | false | NM | 0.000008 | 0 | 0.000008 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219179 | Sm3TmS4 | 47 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[3.94583073,-0.0,0.0],[0.0,5.61473128,0.0],[0.0,0.0,7.94471912]],"pbc":[true,true,true],"a":3.94583073,"b":5.61473128,"c":7.94471912,"alpha":90.0,"beta":90.0,"gamma":90.0,"volume":176.01349811074866},"properties":{"magmom":null,... | false | -21.812026 | -6.638019 | -2.239538 | 0.011459 | false | null | 0 | null | null | 6.20648 | false | true | false | NM | 0.000001 | 0 | 0.000001 | 0 | 0 | [
"Sm2+",
"S2-",
"Tm2+"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219180 | Sm2SbO2 | 139 | Tetragonal | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-1.96295316,1.96295316,6.78929306],[1.96295316,-1.96295316,6.78929306],[1.96295316,1.96295316,-6.78929306]],"pbc":[true,true,true],"a":7.33490766617223,"b":7.33490766617223,"c":7.33490766617223,"alpha":148.95485657626224,"beta"... | false | -22.353555 | -7.652266 | -2.959847 | 0 | true | -0.032948 | 0 | null | null | 4.872067 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [
"O2-",
"Sm3+",
"Sb2-"
] | true | null | null | null | null | null | null | null | false | true | true | false | true |
mp-1219181 | Sm2Si3Pd | 44 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.01296154,2.10628022,7.15309553],[2.01296154,-2.10628022,7.15309553],[2.01296154,2.10628022,-7.15309553]],"pbc":[true,true,true],"a":7.72367828097393,"b":7.72367828097393,"c":7.72367828097393,"alpha":149.7860384939439,"beta":... | false | -19.050242 | -19.050242 | -0.925643 | 0.001466 | false | null | 0 | null | null | 5.657397 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219182 | SiGe | 216 | Cubic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[0.0,2.77146216,2.77146216],[2.77146216,0.0,2.77146216],[2.77146216,2.77146216,0.0]],"pbc":[true,true,true],"a":3.9194393742758327,"b":3.9194393742758327,"c":3.9194393742758327,"alpha":59.99999999999999,"beta":59.99999999999999,... | false | -11.306668 | -11.306668 | 0.016203 | 0.016203 | false | null | 0.606 | 5.7457 | 5.1397 | 5.205134 | false | false | false | NM | 0 | 0 | 0 | 0 | 0 | [
"Ge4+",
"Si4-"
] | true | null | null | null | null | null | null | null | false | true | true | true | true |
mp-1219183 | Sm2Si3Pt | 44 | Orthorhombic | {"@module":"pymatgen.core.structure","@class":"Structure","charge":0.0,"lattice":{"matrix":[[-2.03318928,2.098193,7.11586865],[2.03318928,-2.098193,7.11586865],[2.03318928,2.098193,-7.11586865]],"pbc":[true,true,true],"a":7.692324691379632,"b":7.692324691379632,"c":7.692324691379632,"alpha":149.34760823125762,"beta":14... | false | -23.92059 | -6.250008 | -0.952631 | 0 | true | -0.089788 | 0 | null | null | 5.8597 | false | true | false | NM | 0 | 0 | 0 | 0 | 0 | [] | true | null | null | null | null | null | null | null | false | true | true | false | true |
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