Datasets:
youssefsassi
/
Le-Mat-Bulk_matgen_constrained

Dataset card Data Studio Files
xet
 Community
1
immutable_id
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4
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elements
listlengths
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int64
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20
nelements
int64
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chemical_formula_anonymous
large_stringclasses
529 values
chemical_formula_reduced
large_stringlengths
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lattice_vectors
listlengths
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cartesian_site_positions
listlengths
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species_at_sites
listlengths
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dft_hull
float64
0
0.1
energy
float64
-948.71
-0.22
agm001216647
[ "Na", "Sn", "Tm" ]
4
3
A2BC
NaSn2Tm
[ [ 0, 0, 4.47118562 ], [ 4.74937503, 0, 0 ], [ 0, 4.74937503, 0 ] ]
[ [ 0, 0, 2.23559281 ], [ 2.374687515, 2.374687515, 2.23559281 ], [ 0, 2.374687515, 0 ], [ 2.374687515, 0, 0 ] ]
[ "Na", "Tm", "Sn", "Sn" ]
0.048496
-15.387794
agm005004441
[ "Ga", "Mg", "Pd", "Sr" ]
5
4
A2BCD
Ga2MgPdSr
[ [ 4.34668002, 0, 0 ], [ 0, 4.43366941, 0 ], [ -2.17334001, -2.216834705, 5.71360671 ] ]
[ [ -4.3783407165750534e-17, -3.245918695589097e-16, 5.051626065408849 ], [ 4.040577530757048e-17, 2.2168347049999997, 2.222272991078172 ], [ 2.1733400099999995, -3.8675757608519497e-17, 2.269444585212 ], [ 4.364584819978319e-17, 1.7296101100733137e-18, 0.57...
[ "Sr", "Mg", "Ga", "Ga", "Pd" ]
0.056084
-17.24931
agm005015751
[ "Ge", "Ni", "Pt", "Sr" ]
5
4
A2BCD
Ge2NiPtSr
[ [ 4.32101279, 0, 0 ], [ 0, 4.32101279, 0 ], [ -2.160506395, -2.160506395, 5.20381759 ] ]
[ [ 0, 0, 0 ], [ 2.220446049250313e-16, 2.1605063949999996, 2.601908795 ], [ 2.160506395, 2.160506395, 1.385379052553124 ], [ 3.302269260234425e-17, 3.302269260234425e-17, 3.818438537446876 ], [ 2.1605063949999996, 0, 2.601908795 ] ]
[ "Sr", "Ni", "Ge", "Ge", "Pt" ]
0.041501
-25.886585
agm004917537
[ "H", "In", "Ni", "Pr" ]
12
4
A6B4CD
H6InNi4Pr
[ [ -2.201584976949963, -3.8132570372576917, 0 ], [ -2.201584976949963, 3.8132570372576917, 0 ], [ 0, 0, -6.83737828 ] ]
[ [ 0, 0, -3.41868914 ], [ 0, 0, 0 ], [ -2.201584976949963, 1.271085679085897, -5.582391581705258 ], [ -2.201584976949963, -1.2710856790858975, -5.582391581705258 ], [ -2.201584976949963, -1.2710856790858969, -1.2549866982947422 ], [ ...
[ "Pr", "In", "Ni", "Ni", "Ni", "Ni", "H", "H", "H", "H", "H", "H" ]
0.027299
-54.430563
agm004976580
[ "Mg", "Na", "O", "V" ]
20
4
A6B2CD
MgNaO6V2
[ [ -2.312756936954009, 0, 5.441106692067512 ], [ 5.297790360882528, -5.311065055529735, 0 ], [ 5.297790360882528, 5.311065055529735, 0 ] ]
[ [ 4.719601126644027, 4.124019602924302, 1.360276673016878 ], [ 3.563222658167022, -4.124019602924305, 4.080830019050634 ], [ 4.719601126644026, -3.0312972848281707, 1.360276673016878 ], [ 3.5632226581670228, 3.0312972848281685, 4.080830019050634 ], [ ...
[ "Na", "Na", "Mg", "Mg", "V", "V", "V", "V", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.096257
-136.252104
agm001206159
[ "Bi", "Ga", "In" ]
4
3
A2BC
BiGaIn2
[ [ 0, 0, 4.7681422 ], [ 4.78184089, 0, 0 ], [ 0, 4.78184089, 0 ] ]
[ [ 2.3909204449999995, 2.3909204449999995, 2.3840711 ], [ 0, 0, 2.3840711 ], [ 0, 2.3909204449999995, 0 ], [ 2.3909204449999995, 0, 0 ] ]
[ "Bi", "Ga", "In", "In" ]
0.053647
-12.202179
agm004829798
[ "Pr", "S", "Sm", "Sr" ]
8
4
A4B2CD
Pr2S4SmSr
[ [ 0, -4.088763880000778, 0 ], [ -7.12743762026992, 0, 0 ], [ 2.3369066399970753, 0, -6.755843749188117 ] ]
[ [ -3.56371881013496, -2.044381940000389, 0 ], [ -2.3952654901364223, 0, -3.3779218745940587 ], [ 1.1684533199985376, -2.044381940000389, -3.3779218745940587 ], [ 0, 0, 0 ], [ -4.80447646052225, 0, -1.6873745976262822 ], [ 0.01394548...
[ "Sr", "Pr", "Pr", "Sm", "S", "S", "S", "S" ]
0.034391
-48.653987
agm003611078
[ "Ce", "Dy", "Er" ]
6
3
ABC
CeDyEr
[ [ 3.4477842278331745, 0, 0 ], [ 0, 5.333937374952021, 0 ], [ -1.7187071562003908, 0, 9.963593576280969 ] ]
[ [ 2.585773895768094, 1.3334843437380053, 0.8251750556658848 ], [ -0.8566968241353106, 4.000453031214016, 9.138418520615085 ], [ -0.8492224026038236, 4.000453031214016, 5.823384771868642 ], [ 2.578299474236607, 1.3334843437380053, 4.140208804412327 ], [...
[ "Ce", "Ce", "Dy", "Dy", "Er", "Er" ]
0.094307
-29.663534
agm001123819
[ "Nd", "Rh", "Y" ]
4
3
A2BC
NdRh2Y
[ [ 3.44516526, 0, 0 ], [ 0, 3.44516526, 0 ], [ 0, 0, 7.17196073 ] ]
[ [ 1.72258263, 1.72258263, 0 ], [ 0, 0, 5.448431130609265 ], [ 0, 0, 1.7235295993907351 ], [ 1.72258263, 1.72258263, 3.585980365 ] ]
[ "Y", "Rh", "Rh", "Nd" ]
0.043981
-28.824695
agm003198402
[ "Os", "Rh" ]
6
2
A5B
OsRh5
[ [ 0, 0, -4.39307005 ], [ -2.3654493696596974, -4.09707849098237, 0 ], [ -2.3654493696596974, 4.09707849098237, 0 ] ]
[ [ 0, 0, -2.196535025 ], [ -1.5939907009464884, -2.760872880831646, 0 ], [ -3.959440070606186, -1.3362056101507245, 0 ], [ -1.542917337426418, -8.026845232138336e-17, 0 ], [ -2.365449369659698, 1.3656928303274567, -2.196535025 ], [ -...
[ "Os", "Rh", "Rh", "Rh", "Rh", "Rh" ]
0.040317
-47.753408
mp-22164
[ "Ni", "Pr", "Sn" ]
12
3
ABC
NiPrSn
[ [ 0, -4.61041167, 0 ], [ -7.54137162, 0, 0 ], [ 0, 0, -7.72283487 ] ]
[ [ -0.1502023281064179, -3.4578087525, -1.511861000010596 ], [ -3.9208881381064176, -3.4578087525, -2.3495564349894047 ], [ -7.391169291893582, -1.1526029175, -6.210973869989404 ], [ -3.620483481893582, -1.1526029175, -5.373278435010596 ], [ -6.0918...
[ "Pr", "Pr", "Pr", "Pr", "Ni", "Ni", "Ni", "Ni", "Sn", "Sn", "Sn", "Sn" ]
0.002505
-65.56973
agm004297077
[ "Mn", "Os", "Rh" ]
4
3
A2BC
Mn2OsRh
[ [ 3.01423302, 0, 0 ], [ 0, 3.01423302, 0 ], [ 0, 0, 6.0460179 ] ]
[ [ 0, 0, 4.543495570572777 ], [ 0, 0, 1.502522329427223 ], [ 1.50711651, 1.50711651, 0 ], [ 1.50711651, 1.50711651, 3.02300895 ] ]
[ "Mn", "Mn", "Os", "Rh" ]
0.089304
-37.052539
mp-1046947
[ "Mg", "O", "Si", "Sn" ]
20
4
A6B2CD
MgO6Si2Sn
[ [ 1.8617501070556843, 0, -5.193999215899477 ], [ 5.396613077840879, 4.920603398303977, 0 ], [ 5.396613077840879, -4.920603398303977, 0 ] ]
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[ "Mg", "Mg", "Si", "Si", "Si", "Si", "Sn", "Sn", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.092386
-140.757531
agm2000141757
[ "Ge", "Ta", "Te" ]
14
3
A5BC
GeTaTe5
[ [ 0, -3.8423968800000003, 0 ], [ -15.728873610000194, 0, 0 ], [ 0, 0, -19.20693238 ] ]
[ [ -11.796655207500146, -1.9211984400000002, -0.07177409750683675 ], [ -3.9322184025000486, -1.9211984400000002, -19.135158282493165 ], [ -7.864436805000097, 0, 0 ], [ 0, 0, 0 ], [ -9.29940113366622, -1.9211984400000002, -17.670974645023705 ...
[ "Ta", "Ta", "Ge", "Ge", "Te", "Te", "Te", "Te", "Te", "Te", "Te", "Te", "Te", "Te" ]
0.040691
-66.796425
agm003402730
[ "Ge", "Si", "Tb" ]
10
3
A2B2C
Ge2SiTb2
[ [ 0, -4.09993449, 0 ], [ -5.428392464113854, -2.049967245, 0 ], [ -0.3441986592667865, -2.049967245, -9.696024462823514 ] ]
[ [ -4.288077896491863, -4.09993449, -6.270156354805268 ], [ -3.9022813631227606, -2.0499672450000004, -0.959736547470938 ], [ -1.4845132268887782, -4.09993449, -3.4258681080182463 ], [ -1.8703097602578778, -6.149901734999999, -8.736287915352577 ], [ ...
[ "Tb", "Tb", "Tb", "Tb", "Si", "Si", "Ge", "Ge", "Ge", "Ge" ]
0.092835
-54.392147
agm004976315
[ "Mg", "O", "V", "Zn" ]
20
4
A6B2CD
MgO6V2Zn
[ [ 0.8650146838281724, 0, -5.231960344004214 ], [ 4.952683081463853, 4.539560136962504, 0 ], [ 4.952683081463853, -4.539560136962504, 0 ] ]
[ [ 5.601444094334982, 3.7305160977049368, -3.923970258003161 ], [ 5.168936752420896, -3.7305160977049368, -1.3079900860010536 ], [ 3.650971660438541, 0.9000129657761782, -4.139007071957147 ], [ 7.551916528231423, 0.9000129657761778, -3.708933444049174 ], ...
[ "Mg", "Mg", "V", "V", "V", "V", "Zn", "Zn", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.097319
-134.205189
agm005019275
[ "Mg", "Pd", "Pr", "Si" ]
5
4
A2BCD
MgPdPrSi2
[ [ 4.17002685, 0, 0 ], [ 0, 4.17002685, 0 ], [ -2.085013425, -2.085013425, 5.46648304 ] ]
[ [ 0, 0, 0 ], [ 2.0850134250000005, 0, 2.73324152 ], [ 2.0850134249999996, 2.085013425, 1.1842124206797617 ], [ 8.788808190729477e-18, 8.788808190729477e-18, 4.282270619320239 ], [ -2.220446049250313e-16, 2.0850134250000005, 2.73324152 ] ]
[ "Pr", "Mg", "Si", "Si", "Pd" ]
0
-26.15927
agm005804669
[ "Ge", "Sn", "Ti" ]
8
3
A6BC
GeSnTi6
[ [ -4.67273571, 0, 0 ], [ 0, -2.9659425270938256, -4.9267953135530504 ], [ 0, -2.9659425270938256, 4.9267953135530504 ] ]
[ [ 0, -4.449402518650354, -1.5847498274084744 ], [ 0, -1.4824825355372968, -1.5847498274084737 ], [ 0, -2.9659425270938256, 0.9569043563771835 ], [ -2.336367855, -4.511907859205639, 1.5671407712064898 ], [ -2.336367855, -1.4199771949820126, ...
[ "Ti", "Ti", "Ti", "Ti", "Ti", "Ti", "Sn", "Ge" ]
0.04772
-58.690346
agm002165513
[ "Na", "Rb" ]
4
2
A3B
Na3Rb
[ [ 5.82107134, 0, 0 ], [ 0, 5.82107134, 0 ], [ 0, 0, 5.82107134 ] ]
[ [ 0, 2.91053567, 2.91053567 ], [ 2.91053567, 0, 2.91053567 ], [ 2.91053567, 2.91053567, 0 ], [ 0, 0, 0 ] ]
[ "Na", "Na", "Na", "Rb" ]
0.093645
-4.657157
agm001282619
[ "Na", "Rb" ]
4
2
A3B
NaRb3
[ [ -5.1806314, 0, 0 ], [ 0, 0, -7.63063185 ], [ 2.5903157, -7.65802665, 3.815315925 ] ]
[ [ -1.0850201971948077e-17, -4.114488098878155e-17, -7.056592387998645 ], [ -2.5903156999999997, -3.3653399519525897, 0.6773970190133125 ], [ -2.5903156999999997, -8.502117510023055e-16, -3.20060801857193 ], [ -1.1051599752357787e-16, -4.292686698047412, -3...
[ "Na", "Rb", "Rb", "Rb" ]
0.072992
-4.096032
agm003183062
[ "Mn", "Os", "Ta" ]
4
3
A2BC
MnOs2Ta
[ [ 3.15702195, 0, 0 ], [ 0, 3.15702195, 0 ], [ 0, 0, 6.0383192 ] ]
[ [ 1.578510975, 1.578510975, 3.0191596 ], [ 0, 0, 4.4631841460724315 ], [ 0, 0, 1.5751350539275681 ], [ 1.578510975, 1.578510975, 0 ] ]
[ "Mn", "Os", "Os", "Ta" ]
0.043881
-43.985985
agm005731140
[ "Cd", "Rb", "Sb" ]
9
3
A6B2C
Cd6RbSb2
[ [ 4.58793813, 0, 0 ], [ 0, 4.58793813, 0 ], [ 0, 0, 12.01015805 ] ]
[ [ 0, 0, 0 ], [ 0, 2.293969065, 3.802522929036645 ], [ 2.293969065, 0, 3.802522929036645 ], [ 0, 2.293969065, 8.207635120963353 ], [ 2.293969065, 0, 8.207635120963353 ], [ 2.293969065, 2.293969065, 6.005079025 ], [ 0,...
[ "Rb", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Sb", "Sb" ]
0.045531
-15.639644
agm001002159
[ "Ni", "Ta", "Ti" ]
12
3
ABC
NiTaTi
[ [ 4.84655838, 0, 0 ], [ 2.42327919, 4.22322382, 0 ], [ 2.42327919, 0, 8.99474245 ] ]
[ [ 3.6349187850000004, 2.11161191, 5.886754551440493 ], [ 3.6349187850000004, 2.111611910000001, 3.107987898559507 ], [ 4.84655838, 0, 7.6053591235595075 ], [ 2.42327919, 0, 1.3893833264404933 ], [ 6.058197975, 2.11161191, 6.733456462591493 ...
[ "Ti", "Ti", "Ti", "Ti", "Ni", "Ni", "Ni", "Ni", "Ta", "Ta", "Ta", "Ta" ]
0.014355
-105.155038
agm003162839
[ "Au", "Pt" ]
4
2
A3B
AuPt3
[ [ -1.404796451085732, -2.433178827572935, 0 ], [ -2.809592902171464, 0, 0 ], [ -1.404796451085732, -0.8110596091909783, -9.453780800999763 ] ]
[ [ -4.2143893532571965, -2.433178827572935, -1.0495805115029192e-15 ], [ -4.214389353257196, -2.4331788275729345, -7.044624207131786 ], [ -2.8095929021714636, -1.622119218381957, -4.726890400499883 ], [ -1.404796451085732, -0.8110596091909784, -2.4091565938...
[ "Au", "Pt", "Pt", "Pt" ]
0
-21.480228
agm005020860
[ "Mg", "Sn", "Sr", "Zn" ]
5
4
A2BCD
MgSn2SrZn
[ [ 4.69904287, 0, 0 ], [ 0, 4.69904287, 0 ], [ -2.349521435, -2.349521435, 6.10567495 ] ]
[ [ 0, 0, 0 ], [ -2.220446049250313e-16, 2.3495214350000007, 3.052837475 ], [ 2.3495214350000007, 0, 3.052837475 ], [ 2.349521435, 2.349521435000001, 1.4479764449203705 ], [ 7.363753203797216e-17, 7.363753203797216e-17, 4.657698505079629 ] ...
[ "Sr", "Mg", "Zn", "Sn", "Sn" ]
0.045264
-14.377029
agm003023015
[ "Ge", "Ta", "Ti" ]
10
3
A2B2C
Ge2TaTi2
[ [ 0, 0, 3.44691362 ], [ 6.8617913, 0, 0 ], [ 0, 6.8617913, 0 ] ]
[ [ 2.525696650325212, 5.956592300325212, 0 ], [ 5.956592300325212, 4.336094649674788, 0 ], [ 4.336094649674788, 0.9051989996747883, 0 ], [ 0.9051989996747883, 2.525696650325212, 0 ], [ 1.1645616734113178, 4.595457323411318, 1.72345681 ], ...
[ "Ge", "Ge", "Ge", "Ge", "Ti", "Ti", "Ti", "Ti", "Ta", "Ta" ]
0
-79.706999
agm002145467
[ "Cr", "Ni" ]
4
2
AB
CrNi
[ [ 0, -2.4505604301991335, 0 ], [ -4.04283997, 0, 0 ], [ 0, 0, -4.47883274546397 ] ]
[ [ -1.0107099924999996, 0, -1.5326663293531553 ], [ -3.0321299775000004, 0, -2.946166416110815 ], [ -1.0107099924999996, -1.2252802150995667, -3.759155044036961 ], [ -3.0321299775000004, -1.2252802150995667, -0.7196777014270092 ] ]
[ "Ni", "Ni", "Cr", "Cr" ]
0.055496
-30.703618
agm001223237
[ "Cd", "Sc", "Y" ]
4
3
A2BC
CdSc2Y
[ [ 4.62383822, 0, 0 ], [ 0, 4.62383822, 0 ], [ 0, 0, 4.67426236 ] ]
[ [ 2.31191911, 2.31191911, 2.33713118 ], [ 0, 2.31191911, 0 ], [ 2.31191911, 0, 0 ], [ 0, 0, 2.33713118 ] ]
[ "Y", "Sc", "Sc", "Cd" ]
0.079778
-20.437175
mp-1281818
[ "Mn", "Nb", "O", "Sr" ]
20
4
A6B2CD
MnNbO6Sr2
[ [ 5.673894824239605, 0, 0 ], [ 2.735130863999315, 4.974412559020428, 0 ], [ 2.64545160008214, 1.5674520355079096, 9.300251479339888 ] ]
[ [ 5.5804754353487995, 3.315264256283131, 1.1736719271570422 ], [ 2.706040928156641, 1.5893639006829667, 5.82453247969637 ], [ 8.348436360164419, 4.952500693845371, 3.4757189996435183 ], [ 5.47400185297226, 3.2266003382452064, 8.126579552182847 ], [ ...
[ "Sr", "Sr", "Sr", "Sr", "Mn", "Mn", "Nb", "Nb", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.006323
-152.883538
mp-1017534
[ "Cd", "Se", "Zn" ]
4
3
A2BC
CdSe2Zn
[ [ 4.20706882, 0, 0 ], [ 0, 4.20706882, 0 ], [ 0, 0, 6.02766651 ] ]
[ [ 2.10353441, 2.10353441, 3.013833255 ], [ 0, 0, 0 ], [ 0, 2.10353441, 4.380323516646526 ], [ 2.10353441, 0, 1.647342993353474 ] ]
[ "Zn", "Cd", "Se", "Se" ]
0.013871
-11.789865
agm005021607
[ "Mn", "Ni", "P", "Sr" ]
5
4
A2BCD
MnNiP2Sr
[ [ 3.77297653, 0, 0 ], [ 0, 3.77297653, 0 ], [ -1.886488265, -1.886488265, 5.97405149 ] ]
[ [ 0, 0, 0 ], [ 2.220446049250313e-16, 1.8864882649999999, 2.987025745 ], [ 1.8864882649999999, 0, 2.987025745 ], [ 1.8864882650000003, 1.8864882650000003, 1.7793013996345814 ], [ 6.280153454344485e-17, 6.280153454344485e-17, 4.1947500903654...
[ "Sr", "Mn", "Ni", "P", "P" ]
0
-31.500078
agm005543980
[ "Cu", "Li" ]
5
2
A4B
CuLi4
[ [ -2.03921866, -2.0598882524527604, 0 ], [ -2.03921866, 2.0598882524527604, 0 ], [ 2.03921866, 0, -9.909856984282358 ] ]
[ [ -2.03921866, 5.1915998281658304e-17, -1.6131700241736455 ], [ 1.3833921396417272e-17, 1.882783352089068e-17, -3.8374220640174954 ], [ -2.03921866, -7.433898475214851e-17, -6.072434920264863 ], [ -7.625893360833515e-17, -5.1915998281658304e-17, -8.2966869...
[ "Li", "Li", "Li", "Li", "Cu" ]
0.029699
-11.734396
agm005018748
[ "Mn", "Ni", "Si", "Sm" ]
5
4
A2BCD
MnNiSi2Sm
[ [ 3.98839519, 0, 0 ], [ 0, 3.98839519, 0 ], [ -1.994197595, -1.994197595, 4.91588898 ] ]
[ [ 0, 0, 0 ], [ 0, 1.9941975949999997, 2.45794449 ], [ 1.994197595, 1.994197595, 1.2827986730687309 ], [ -3.6472074458848174e-17, -3.6472074458848174e-17, 3.6330903069312694 ], [ 1.9941975949999997, 0, 2.45794449 ] ]
[ "Sm", "Mn", "Si", "Si", "Ni" ]
0.040456
-33.880991
agm004949648
[ "Mn", "O", "Te", "Zn" ]
20
4
A6B2CD
MnO6TeZn2
[ [ 0.6877228522955583, 0, -5.460390038585729 ], [ 4.868339399374923, 4.655064178756901, 0 ], [ 4.868339399374923, -4.655064178756901, 0 ] ]
[ [ 5.384131538596591, 3.8519388970743886, -4.0952925289392965 ], [ 5.0402701124488125, -3.851938897074389, -1.3650975096464322 ], [ 3.6475530114336645, 0.9012107424738452, -4.357131172413873 ], [ 7.1207100657595195, 0.9012107424738452, -3.8334538854647198 ...
[ "Mn", "Mn", "Zn", "Zn", "Zn", "Zn", "Te", "Te", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0
-112.921259
agm005020323
[ "Mn", "P", "Pr", "Ru" ]
5
4
A2BCD
MnP2PrRu
[ [ 4.03123169, 0, 0 ], [ 0, 4.03123169, 0 ], [ -2.015615845, -2.015615845, 5.03299542 ] ]
[ [ 0, 0, 0 ], [ -1.1015544892911677e-16, 2.015615845, 2.5164977099999994 ], [ 2.015615845, 2.015615845, 1.4167954079134486 ], [ -1.0967423576558704e-16, -3.3171884069061834e-16, 3.61620001208655 ], [ 2.015615845, -1.1015544892911677e-16, 2.5...
[ "Pr", "Mn", "P", "P", "Ru" ]
0.030384
-38.68621
mp-865664
[ "Re", "Ti", "W" ]
4
3
A2BC
Re2TiW
[ [ -3.13622069, -3.13622069, 0 ], [ -3.13622069, 0, -3.13622069 ], [ 0, -3.13622069, -3.13622069 ] ]
[ [ -3.13622069, -3.13622069, -3.13622069 ], [ -4.704331035, -4.704331035, -4.704331035 ], [ -1.5681103450000005, -1.5681103449999996, -1.568110345 ], [ 0, 0, 0 ] ]
[ "Ti", "Re", "Re", "W" ]
0
-47.130168
agm003521559
[ "Ag", "Cl", "Pb" ]
11
3
A8B2C
Ag2Cl8Pb
[ [ 7.00052896, 0, 0 ], [ 0, 7.00052896, 0 ], [ -3.50026448, -3.50026448, 6.3220667 ] ]
[ [ 3.50026448, -2.7740894026351282e-17, 3.1610333499999994 ], [ 1.9430371089868003e-16, 3.500264479999999, 3.1610333499999994 ], [ -5.5481788052702564e-17, -5.5481788052702564e-17, 6.322066699999999 ], [ 4.714269925256956, 1.1808907731121765, 1.529302560973...
[ "Ag", "Ag", "Pb", "Cl", "Cl", "Cl", "Cl", "Cl", "Cl", "Cl", "Cl" ]
0.055887
-29.022843
agm003165617
[ "Mn", "Pt", "Ta" ]
4
3
A2BC
MnPt2Ta
[ [ 2.84361016, 0, 0 ], [ 0, 3.9388888099999995, 0 ], [ 0, 0, 5.55314298 ] ]
[ [ 1.42180508, 1.9694444049999997, 2.77657149 ], [ 0, 0, 4.136779544527384 ], [ 0, 0, 1.416363435472616 ], [ 1.42180508, 1.9694444049999997, 0 ] ]
[ "Mn", "Pt", "Pt", "Ta" ]
0.053472
-35.258375
agm003161064
[ "Au", "Hg", "La" ]
3
3
ABC
AuHgLa
[ [ 0, 0, -3.62727314 ], [ -2.466613833320113, -4.272300481962666, 0 ], [ -2.466613833320113, 4.272300481962666, 0 ] ]
[ [ 0, 0, 0 ], [ -2.4666138333201135, 1.4241001606542216, 0 ], [ -2.466613833320113, -1.4241001606542223, -1.81363657 ] ]
[ "Au", "Hg", "La" ]
0.031917
-10.49078
agm005019672
[ "Mn", "Si", "Tb", "V" ]
5
4
A2BCD
MnSi2TbV
[ [ 3.90942767, 0, 0 ], [ 0, 3.90942767, 0 ], [ -1.954713835, -1.954713835, 5.35859342 ] ]
[ [ 0, 0, 0 ], [ 1.9547138350000002, -2.5138871539986976e-18, 2.6792967099999996 ], [ -1.1353618961651436e-16, 1.9547138350000006, 2.6792967099999996 ], [ 1.954713835, 1.954713835, 1.2157659809493992 ], [ -1.3903862945340956e-17, -1.3903862945340...
[ "Tb", "Mn", "V", "Si", "Si" ]
0.060495
-36.719586
agm005009881
[ "Mo", "Nb", "Ta", "Ti" ]
10
4
A2BCD
MoNb2TaTi
[ [ 0, -4.59990354, 0 ], [ -5.413100737349119, 0, 0 ], [ 1.4672331419833637, 0, -6.985091038350243 ] ]
[ [ -4.94364024388383, -3.4499276549999998, -0.9893668278028122 ], [ 0.9977726485180751, -1.149975885, -5.99572421054743 ], [ -0.6249867518813399, -3.4499276549999998, -6.567655362061946 ], [ -3.320880843484415, -1.149975885, -0.4174356762882964 ], [ ...
[ "Ta", "Ta", "Ti", "Ti", "Nb", "Nb", "Nb", "Nb", "Mo", "Mo" ]
0.0621
-102.133642
agm005894433
[ "Ce", "Cu", "Tm" ]
10
3
A3BC
CeCu3Tm
[ [ -3.47771018331494, 0, 0 ], [ 0, 0, -4.34745573 ], [ 1.73885509165747, -12.965470707263478, 0 ] ]
[ [ -1.7388550916574699, -11.060725074583042, -1.0868639325 ], [ -2.1177121486568427e-16, -1.9047456326804368, -3.2605917975 ], [ -2.022221530602257e-17, -5.338478368048182, -1.0868639325 ], [ -1.7388550916574699, -7.626992339215295, -3.2605917975 ], [ ...
[ "Ce", "Ce", "Tm", "Tm", "Cu", "Cu", "Cu", "Cu", "Cu", "Cu" ]
0.034309
-47.253341
agm001138027
[ "Ce", "Ga", "Ho" ]
4
3
A2BC
CeGa2Ho
[ [ 3.39024762, 0, 0 ], [ 0, 3.39024762, 0 ], [ 0, 0, 7.9610839 ] ]
[ [ 0, 0, 6.0344512821497505 ], [ 0, 0, 1.9266326178502498 ], [ 1.69512381, 1.69512381, 0 ], [ 1.69512381, 1.69512381, 3.98054195 ] ]
[ "Ga", "Ga", "Ho", "Ce" ]
0.033591
-18.699656
agm002746959
[ "Re", "Ti", "V" ]
4
3
A2BC
Re2TiV
[ [ -3.07467366, -3.07467366, 0 ], [ -3.07467366, 0, -3.07467366 ], [ 0, -3.07467366, -3.07467366 ] ]
[ [ -4.61201049, -4.61201049, -4.61201049 ], [ -1.53733683, -1.5373368299999997, -1.5373368299999997 ], [ -3.07467366, -3.0746736599999998, -3.0746736599999998 ], [ 0, 0, 0 ] ]
[ "Re", "Re", "V", "Ti" ]
0.009723
-43.477327
agm003278183
[ "Mo", "S", "Te", "W" ]
12
4
A6B3C2D
Mo3S6Te2W
[ [ -1.6361867141478377, -2.8339585195732298, 0 ], [ -1.6361867141478377, 2.8339585195732298, 0 ], [ 0, 0, -31.62205627 ] ]
[ [ -1.636186714147838, -0.9446528398577436, -24.40030213057946 ], [ -1.636186714147838, -0.9446528398577436, -20.54049528525006 ], [ -1.636186714147838, -0.9446528398577436, -1.486311905183916 ], [ -1.636186714147838, -0.9446528398577436, -15.18440420307142...
[ "Te", "Te", "Mo", "Mo", "Mo", "W", "S", "S", "S", "S", "S", "S" ]
0.062148
-84.340421
agm002325478
[ "Rh", "Zn" ]
6
2
A2B
RhZn2
[ [ 4.604612419202011, 0, 0 ], [ -2.264606719372509, 4.014853462995763, 0 ], [ -1.1475267763695294, -1.9996361109514251, 4.5786861375017205 ] ]
[ [ -0.5672428661618455, -0.3220854522950905, 3.4353450319572647 ], [ 1.7597217896218182, 2.3373028043394286, 1.1433411055444558 ], [ -0.5113729991824325, 2.3364104007635986, 3.4341936755411298 ], [ 1.7038519226424056, -0.32119304871926085, 1.144492461960591...
[ "Zn", "Zn", "Zn", "Zn", "Rh", "Rh" ]
0.049887
-21.831081
agm005877024
[ "Be", "Ni", "Tb" ]
12
3
A3B2C
Be3Ni2Tb
[ [ 0, 0, 4.94306907 ], [ 4.42850100254485, 3.4236858075946266, 0 ], [ -4.42850100254485, 3.4236858075946266, 0 ] ]
[ [ 1.0522139226928531e-16, 2.241574402220296, 1.2357672675 ], [ 1.16823212655746e-16, 4.605797212968957, 3.7073018025 ], [ 1.6532481714100833, 1.9048735278941573, 3.7073018025 ], [ -1.653248171410083, 1.9048735278941573, 3.7073018025 ], [ -1.6532481...
[ "Tb", "Tb", "Be", "Be", "Be", "Be", "Be", "Be", "Ni", "Ni", "Ni", "Ni" ]
0.042195
-58.837322
agm006099749
[ "Au", "La", "Zn" ]
11
3
A6B4C
Au4LaZn6
[ [ 0, 0, -4.24627825 ], [ -3.738425201899034, -6.475142389985065, 0 ], [ -3.738425201899034, 6.475142389985065, 0 ] ]
[ [ 0, 0, 0 ], [ -2.305182831965841, 2.985863664756594, 0 ], [ -5.14748599833264, -1.344859166536197, -2.123139125 ], [ -3.738425201899035, 0.5034150604718763, 0 ], [ -5.171667571832227, 2.9858636647565935, 0 ], [ -3.738425201899034, ...
[ "La", "Zn", "Zn", "Zn", "Zn", "Zn", "Zn", "Au", "Au", "Au", "Au" ]
0
-29.937076
agm004989290
[ "N", "Nd", "Sm", "Zn" ]
5
4
A2BCD
NNd2SmZn
[ [ 0, 0, 4.8981435931058535 ], [ 4.999707270018034, 0, 0 ], [ 0, 4.999707270018034, 0 ] ]
[ [ 0, 2.499853635009017, 0 ], [ 2.499853635009017, 0, 0 ], [ 0, 0, 2.4490717965529267 ], [ 2.499853635009017, 2.499853635009017, 2.4490717965529267 ], [ 0, 0, 0 ] ]
[ "Nd", "Nd", "Sm", "Zn", "N" ]
0.076692
-27.069243
agm001160240
[ "Ce", "Hg", "La" ]
4
3
A2BC
CeHgLa2
[ [ 3.72454233, 0, 0 ], [ 0, 3.72454233, 0 ], [ 0, 0, 8.89817567 ] ]
[ [ 1.862271165, 1.862271165, 0 ], [ 1.862271165, 1.862271165, 4.449087835 ], [ 0, 0, 6.791731365371967 ], [ 0, 0, 2.1064443046280332 ] ]
[ "Hg", "Ce", "La", "La" ]
0.053175
-16.919088
agm001273091
[ "Ce", "Hg", "Mg" ]
3
3
ABC
CeHgMg
[ [ 0, 0, -3.36038607 ], [ -2.542773884162975, -4.404213559529531, 0 ], [ -2.542773884162975, 4.404213559529531, 0 ] ]
[ [ 0, 0, -1.680193035 ], [ -2.5427738841629752, 1.4680711865098437, -1.680193035 ], [ -2.542773884162975, -1.4680711865098435, 0 ] ]
[ "Mg", "Hg", "Ce" ]
0.035833
-8.556004
agm005761960
[ "Ce", "Hg", "Tl" ]
9
3
A6B2C
CeHg6Tl2
[ [ 0, 0, -3.379264724849692 ], [ -4.547779642839334, -7.876985403025168, 0 ], [ -4.547779642839334, 7.876985403025168, 0 ] ]
[ [ 0, 0, 0 ], [ -4.547779642839334, -2.62566180100839, 0 ], [ -4.547779642839334, 2.6256618010083903, 0 ], [ -1.519883782910062, -2.632515933600213, -1.689632362424846 ], [ -6.067663425749396, -5.244469469424955, -1.689632362424846 ], [ ...
[ "Ce", "Tl", "Tl", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg" ]
0.04603
-13.446622
agm005606001
[ "Ce", "Ho", "Ru" ]
12
3
A3B2C
CeHo3Ru2
[ [ 0, 0, -6.23553726 ], [ -4.666244163812794, -4.962729432536558, 0 ], [ -4.666244163812794, 4.962729432536558, 0 ] ]
[ [ -4.666244163812794, 0.6841115574930441, -1.558884315 ], [ -4.666244163812794, -0.6841115574930451, -4.676652945 ], [ -4.666244163812794, 4.340328522245808, -1.558884315 ], [ -4.666244163812794, -4.340328522245808, -4.676652945 ], [ -6.34994843361...
[ "Ce", "Ce", "Ho", "Ho", "Ho", "Ho", "Ho", "Ho", "Ru", "Ru", "Ru", "Ru" ]
0.045285
-80.648224
mp-1217759
[ "N", "O", "Sr", "Ta" ]
5
4
A2BCD
NO2SrTa
[ [ -4.055456369953076, 0, 0 ], [ 0, 0, -4.07567151 ], [ 0, -4.097851847973659, 0 ] ]
[ [ 0, 0, -0.018169751158731085 ], [ -2.027728184976538, -2.0489259239868294, -2.0839760245975594 ], [ -2.027728184976538, 0, -1.9609790240404652 ], [ 0, -2.0489259239868294, -2.0575728463946166 ], [ -2.027728184976538, -2.0489259239868294, -...
[ "Sr", "Ta", "N", "O", "O" ]
0.06822
-43.475319
agm001209377
[ "Ce", "In", "Tm" ]
4
3
A2BC
Ce2InTm
[ [ 4.59622647, 0, 0 ], [ 0, 4.59622647, 0 ], [ 0, 0, 5.15739354 ] ]
[ [ 2.298113235, 2.298113235, 2.57869677 ], [ 0, 2.298113235, 0 ], [ 2.298113235, 0, 0 ], [ 0, 0, 2.57869677 ] ]
[ "Tm", "Ce", "Ce", "In" ]
0.032012
-19.924007
agm005776375
[ "Al", "H", "Ti" ]
9
3
A6B2C
Al2HTi6
[ [ -4.0578036636215975, -4.0578036636215975, 0 ], [ -4.0578036636215975, 0, -4.0578036636215975 ], [ 0, -4.0578036636215975, -4.0578036636215975 ] ]
[ [ -6.099739079643876, -4.0578036636215975, -4.0578036636215975 ], [ -4.0578036636215975, -4.0578036636215975, -6.099739079643876 ], [ -4.0578036636215975, -4.0578036636215975, -2.015868247599319 ], [ -4.0578036636215975, -6.099739079643876, -4.057803663621...
[ "Ti", "Ti", "Ti", "Ti", "Ti", "Ti", "Al", "Al", "H" ]
0.006388
-61.178223
agm003586954
[ "Ce", "Ir", "Tb" ]
12
3
A8B3C
CeIr8Tb3
[ [ -2.6902893898823326, -4.659717910339676, 0 ], [ -5.380578779764665, 0, 0 ], [ -2.6902893898823326, -1.5532393034465586, -8.775668919999998 ] ]
[ [ -5.380578779764665, -3.106478606893117, -1.0873353042190173 ], [ -8.070868169646998, -4.659717910339675, -0.0175944263743984 ], [ -5.380578779764666, -3.106478606893118, -4.370432922828467 ], [ -2.6902893898823326, -1.5532393034465586, -5.493721879342654...
[ "Tb", "Tb", "Tb", "Ce", "Ir", "Ir", "Ir", "Ir", "Ir", "Ir", "Ir", "Ir" ]
0.005302
-100.22727
agm004892421
[ "Ba", "F", "Ho", "Rb" ]
12
4
A8B2CD
BaF8HoRb2
[ [ 6.26830134, 0, 0 ], [ 0, 6.26830134, 0 ], [ -3.13415067, -3.13415067, 5.93043711 ] ]
[ [ 4.440892098500626e-16, 3.1341506699999995, 2.965218555 ], [ 0, 0, 0 ], [ 3.13415067, 3.13415067, 0 ], [ 3.1341506699999995, 0, 2.965218555 ], [ -1.754149528975603, -1.2717813003438048, 4.30205507894387 ], [ -1.754149528975603, ...
[ "Rb", "Rb", "Ba", "Ho", "F", "F", "F", "F", "F", "F", "F", "F" ]
0.058505
-62.509715
agm004938328
[ "Ba", "F", "K", "Mn" ]
20
4
A6B2CD
BaF6K2Mn
[ [ -6.323782374304056, 0, 0 ], [ 0, -6.54020359, 0 ], [ 0.14069799246536085, 0, 9.049245835293505 ] ]
[ [ -6.108581444688653, -6.208468963632693, 6.782401337753854 ], [ -3.0170392537693047, -3.6018364213673078, 2.257778420107102 ], [ -0.07450293715004214, -0.33173462636730694, 2.2668444975396502 ], [ -3.1660451280693898, -2.9383671686326918, 6.79146741518640...
[ "K", "K", "K", "K", "Ba", "Ba", "Mn", "Mn", "F", "F", "F", "F", "F", "F", "F", "F", "F", "F", "F", "F" ]
0.091758
-106.533706
agm003415809
[ "Ce", "Mg", "Tl" ]
12
3
A3B2C
Ce2MgTl3
[ [ -3.40868062, 0, 0 ], [ 0, 0, -6.53505617 ], [ 1.70434031, -15.16532131, 0 ] ]
[ [ -1.70434031, -10.252221416045293, -4.9012921275 ], [ 1.5538680574333912e-16, -4.913099893954707, -1.6337640425 ], [ 1.8924301770149938e-16, -0.004260242062403786, -4.9012921275 ], [ -1.7043403100000003, -15.161061067937597, -1.6337640425 ], [ -1....
[ "Ce", "Ce", "Ce", "Ce", "Mg", "Mg", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl" ]
0.099574
-42.636508
agm004873405
[ "Ba", "O", "Ta", "Tl" ]
11
4
A7B2CD
BaO7Ta2Tl
[ [ 4.00994086, 0, 0 ], [ 0, 4.00994086, 0 ], [ -2.00497043, -2.00497043, 10.75568247 ] ]
[ [ 2.00497043, 2.00497043, 0 ], [ 2.0049704300000006, 2.00497043, 8.57978435137439 ], [ -2.7063887918980376e-17, -2.7063887918980376e-17, 2.1758981186256103 ], [ 2.00497043, 0, 5.377841235 ], [ 2.00497043, 2.647070673172963e-17, 2.0528057861...
[ "Ba", "Ta", "Ta", "Tl", "O", "O", "O", "O", "O", "O", "O" ]
0.082212
-90.188542
agm004988761
[ "N", "Tb", "Y", "Zn" ]
5
4
A2BCD
NTb2YZn
[ [ 0, 0, 4.773626102992959 ], [ 4.806946865015138, 0, 0 ], [ 0, 4.806946865015138, 0 ] ]
[ [ 0, 2.403473432507569, 0 ], [ 2.403473432507569, 0, 0 ], [ 0, 0, 2.3868130514964796 ], [ 2.403473432507569, 2.403473432507569, 2.3868130514964796 ], [ 0, 0, 0 ] ]
[ "Tb", "Tb", "Y", "Zn", "N" ]
0.04984
-29.228526
mp-1221073
[ "Ce", "Na", "S" ]
4
3
A2BC
CeNaS2
[ [ -2.0708348851397744, -3.5867912351481497, 0 ], [ -4.141669770279549, 0, 0 ], [ -2.0708348851397744, -1.1955970783827166, -6.682040647667177 ] ]
[ [ -4.141669770279551, -2.3911941567654336, -3.341020323833593 ], [ -1.0027487937348483e-16, -7.976162985398913e-17, 0 ], [ -2.0708348851397744, -1.1955970783827168, -1.554613708364556 ], [ -6.212504655419322, -3.5867912351481497, -5.127426939302623 ] ]
[ "Na", "Ce", "S", "S" ]
0
-22.454842
mp-1005755
[ "Ge", "Pt", "Sm" ]
16
3
A2BC
Ge2PtSm
[ [ 4.41211421, 0, 0 ], [ 0, 8.81404924, 0 ], [ -2.206057105, -4.40702462, 8.25059318 ] ]
[ [ 2.206057105, -2.280698702004528, 8.25059318 ], [ -4.804509912887051e-18, 6.687723322004529, 4.792459164724506e-17 ], [ -1.4185346944858405e-17, -5.83948074686106e-17, 3.347646665519051 ], [ 2.206057105, 4.40702462, 4.902946514480946 ], [ 2.206057...
[ "Sm", "Sm", "Sm", "Sm", "Ge", "Ge", "Ge", "Ge", "Ge", "Ge", "Ge", "Ge", "Pt", "Pt", "Pt", "Pt" ]
0
-94.417836
agm001962614
[ "Ce", "Ho", "Sc" ]
4
3
A2BC
CeHoSc2
[ [ -1.690772044335243, -2.9285030848057385, 0 ], [ -3.381544088670486, 0, 0 ], [ -1.690772044335243, -0.9761676949352462, -10.84619566 ] ]
[ [ -1.6907720443352432, -0.9761676949352466, -2.665567119271178 ], [ -5.072316133005729, -2.928503084805739, -8.180628540728831 ], [ -3.3815440886704873, -1.952335389870493, -5.423097830000004 ], [ -1.690772044335243, -2.9285030848057385, 0 ] ]
[ "Sc", "Sc", "Ho", "Ce" ]
0.067212
-22.91326
agm001223751
[ "Ce", "In", "Sc" ]
4
3
A2BC
Ce2InSc
[ [ 4.46237306, 0, 0 ], [ 0, 4.46237306, 0 ], [ 0, 0, 5.1283453 ] ]
[ [ 0, 0, 2.56417265 ], [ 0, 2.23118653, 0 ], [ 2.23118653, 0, 0 ], [ 2.23118653, 2.23118653, 2.56417265 ] ]
[ "Sc", "Ce", "Ce", "In" ]
0.028286
-21.862742
agm003606207
[ "Be", "Os", "Sc" ]
6
3
ABC
BeOsSc
[ [ 4.9329748834294875, 0, 0 ], [ 2.4664874417147438, 2.5664682475672826, 3.4644886992451402 ], [ 2.4664874417147438, -2.5664682475672826, 3.4644886992451402 ] ]
[ [ 7.399462325144232, 1.283234123783641, 4.3541851259899875 ], [ 2.466487441714744, -1.2832341237836413, 2.5747922725002934 ], [ 1.2332437208573719, 1.2832341237836413, 1.7322443496225701 ], [ 3.6997311625721157, 1.2832341237836413, 1.7322443496225701 ], ...
[ "Sc", "Sc", "Be", "Be", "Os", "Os" ]
0
-44.971149
agm004487338
[ "Br", "O", "Pb", "Ti" ]
11
4
A5B2C2D2
Br2O5Pb2Ti2
[ [ 3.83433467, 0, 0 ], [ 0, 3.83433467, 0 ], [ -1.917167335, -1.917167335, 14.61974354 ] ]
[ [ -4.39396305563555e-18, -4.39396305563555e-18, 1.805260552062739 ], [ 1.917167335, 1.917167335, 12.814482987937257 ], [ 4.255699707343724e-17, 4.255699707343724e-17, 10.596132371713384 ], [ 1.9171673350000003, 1.9171673350000003, 4.02361116828661 ], [...
[ "Ti", "Ti", "Pb", "Pb", "Br", "Br", "O", "O", "O", "O", "O" ]
0.064294
-74.108067
agm004976201
[ "Na", "O", "Rb", "V" ]
20
4
A6B2CD
NaO6RbV2
[ [ -1.68767441705875, 0, 5.763602569930522 ], [ 5.47200824689172, -5.918642607524474, 0 ], [ 5.47200824689172, 5.918642607524474, 0 ] ]
[ [ 5.050089642627032, 4.638499753061561, 1.4409006424826305 ], [ 4.206252434097657, -4.638499753061561, 4.322701927447891 ], [ 5.050089642627033, -2.9210436664265944, 1.4409006424826305 ], [ 4.2062524340976575, 2.9210436664265944, 4.322701927447891 ], [...
[ "Rb", "Rb", "Na", "Na", "V", "V", "V", "V", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.027943
-132.897393
agm005816771
[ "Al", "Hf", "Zn" ]
10
3
A3BC
AlHf3Zn
[ [ 0, 0, 4.64135716 ], [ 4.649456439334275, 0, 0 ], [ -2.3247282196671377, 9.021789040462146, 0 ] ]
[ [ 2.3247282196671377, 8.035318388578313, 3.48101787 ], [ 2.3247282196671377, 0.9869617980791873, 3.48101787 ], [ 2.3247282196671377, 4.5116234807855395, 3.48101787 ], [ -3.559312380691896e-17, 8.034827242382958, 1.16033929 ], [ 1.015340201874762e-1...
[ "Hf", "Hf", "Hf", "Hf", "Hf", "Hf", "Al", "Al", "Zn", "Zn" ]
0.057321
-71.981141
mp-559773
[ "Na", "O", "Si", "Sr" ]
17
4
A9B4C3D
Na4O9Si3Sr
[ [ -3.844812074474213, 0, 5.449402263520796 ], [ 3.8653597356041365, -5.463312947995115, 0 ], [ 3.8653597356041365, 5.463312947995115, 0 ] ]
[ [ 3.8653597356041365, 0.040782265328547763, 0 ], [ 1.94295369836703, 5.216660867598239, 2.724701131760398 ], [ 1.7658879209294986, 2.897721465056868, 5.3190985543324825 ], [ 2.1200194758045607, 2.8977214650568666, 0.13030370918831363 ], [ 1.9429536...
[ "Na", "Na", "Na", "Na", "Sr", "Si", "Si", "Si", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.042238
-110.520211
agm004949735
[ "Na", "O", "Tb", "Te" ]
20
4
A6B2CD
Na2O6TbTe
[ [ 5.713846456882321, 0, 0 ], [ 0, 5.8272907400011436, 0 ], [ 0.001593369559552471, 0, 8.151939096972086 ] ]
[ [ 0.044675516147832786, 0.18424028586846816, 6.0949682935334355 ], [ 2.9008020598092163, 2.729405084132104, 2.0189987450473925 ], [ 5.6707643102940395, 5.643050454132675, 2.05697080343865 ], [ 2.814637766632656, 3.0978856558690397, 6.1329403519246934 ], ...
[ "Na", "Na", "Na", "Na", "Tb", "Tb", "Te", "Te", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.082822
-116.838679
agm004975830
[ "Na", "O", "Te", "Tm" ]
20
4
A6B2CD
NaO6Te2Tm
[ [ -1.0393426823478735, 0, 6.184301474161495 ], [ 4.529560263185026, -5.417470952438729, 0 ], [ 4.529560263185026, 5.417470952438729, 0 ] ]
[ [ 3.7500532514241205, -2.523096082586339, 4.638226105621121 ], [ 4.269724592598058, 2.5230960825863393, 1.5460753685403736 ], [ 3.75005325142412, 4.498357782867802, 4.638226105621121 ], [ 4.269724592598058, -4.498357782867801, 1.5460753685403736 ], [ ...
[ "Na", "Na", "Tm", "Tm", "Te", "Te", "Te", "Te", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.085456
-119.437438
agm002386988
[ "Na", "P", "Pd", "Tb" ]
6
4
A2B2CD
NaP2Pd2Tb
[ [ -2.0245627660871044, -3.506645573975049, 0 ], [ -2.0245627660871044, 3.506645573975049, 0 ], [ 0, 0, -8.39893429 ] ]
[ [ -2.0245627660871044, -1.1688818579916833, -6.549186009782161 ], [ -2.0245627660871044, 1.1688818579916838, -1.8497482802178384 ], [ 0, 0, 0 ], [ -2.0245627660871044, -1.1688818579916833, -2.1034208726319936 ], [ -2.0245627660871044, 1.1688818...
[ "P", "P", "Tb", "Pd", "Pd", "Na" ]
0.024199
-32.264692
agm001275454
[ "Al", "Hg", "Tm" ]
3
3
ABC
AlHgTm
[ [ 0, 0, -3.53464501 ], [ -2.31469020675142, -4.0091610418755685, 0 ], [ -2.31469020675142, 4.0091610418755685, 0 ] ]
[ [ -2.31469020675142, 1.3363870139585226, 0 ], [ -2.31469020675142, -1.3363870139585232, -1.767322505 ], [ 0, 0, -1.767322505 ] ]
[ "Tm", "Hg", "Al" ]
0.007522
-9.826013
agm003226457
[ "Na", "P", "S", "Yb" ]
20
4
A6B2CD
NaP2S6Yb
[ [ 7.048721607145247, 0, 0 ], [ 0.2001192702280034, 7.4064534835405365, 0 ], [ 2.6212970550447188, 0.05781344679492019, 9.738946071589647 ] ]
[ [ 4.608460189096247, 2.734394147481737, 3.120369910683149 ], [ 5.261677743321722, 4.729872782853719, 6.618576160906498 ], [ 5.6694951179931445, 7.419467144528341, 2.562115991756701 ], [ 7.230775226238311, 1.868863664161344, 9.50816664905692 ], [ 7....
[ "Na", "Na", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "Yb", "Yb", "P", "P", "P", "P" ]
0.043007
-92.786571
agm002140574
[ "C", "Mo", "Si", "Sr" ]
6
4
A2B2CD
CMo2Si2Sr
[ [ 4.22867117, 0, 0 ], [ 0, 4.22867117, 0 ], [ 0, 0, 5.61261485 ] ]
[ [ 0, 0, 0 ], [ 0, 0, 2.806307425 ], [ 2.114335585, 0, 0 ], [ 0, 2.114335585, 0 ], [ 2.114335585, 2.114335585, 4.069478369806011 ], [ 2.114335585, 2.114335585, 1.543136480193989 ] ]
[ "C", "Sr", "Mo", "Mo", "Si", "Si" ]
0.076392
-45.083123
agm005644836
[ "Al", "Ho", "Sc" ]
6
3
ABC
AlHoSc
[ [ -3.572452954051564, 0, 0 ], [ 0, 0, -5.07547703 ], [ 1.786226477025782, -7.822232543319065, 0 ] ]
[ [ -4.673441985662006e-17, -6.583758958984619, -3.8066077725 ], [ -1.786226477025782, -1.2384735843344459, -1.2688692575 ], [ -1.786226477025782, -3.6271721245630895, -3.8066077725 ], [ 4.1162832732076513e-17, -4.1950604187559755, -1.2688692575 ], [ ...
[ "Ho", "Ho", "Sc", "Sc", "Al", "Al" ]
0.031183
-31.061423
agm005000789
[ "Co", "Ge", "La", "N" ]
10
4
A2BCD
CoGeLa2N
[ [ 0, -3.98876721, 0 ], [ -6.470632110098587, 0, 0 ], [ 2.8894998847723476, 0, -8.080917679817887 ] ]
[ [ -0.2794593744439906, -2.9915754075, -3.126658567528037 ], [ 1.3660254540934842, -2.9915754075, -7.810075299394983 ], [ -3.301672850882249, -0.9971918024999995, -4.95425911228985 ], [ -4.947157679419723, -0.9971918024999995, -0.2708423804229035 ], [ ...
[ "La", "La", "La", "La", "Co", "Co", "Ge", "Ge", "N", "N" ]
0.063351
-68.24728
agm004488198
[ "Na", "Sb", "Sn", "Zn" ]
11
4
A4B3C2D2
Na3Sb4Sn2Zn2
[ [ -2.236710050346427, -3.874095448999953, 0 ], [ -2.236710050346427, 3.874095448999953, 0 ], [ 0, 0, -18.56032929 ] ]
[ [ 0, 0, -4.469483199798034 ], [ 0, 0, 0 ], [ 0, 0, -14.090846090201964 ], [ -2.2367100503464274, 1.291365149666651, -2.6613932717837367 ], [ -2.236710050346427, -1.2913651496666507, -15.898936018216261 ], [ -2.2367100503464274, ...
[ "Na", "Na", "Na", "Zn", "Zn", "Sn", "Sn", "Sb", "Sb", "Sb", "Sb" ]
0.039332
-33.204267
agm003200439
[ "Be", "Ta", "Ti" ]
6
3
A4BC
Be4TaTi
[ [ -3.230976142011246, -3.230976142011246, 0 ], [ -3.230976142011246, 0, -3.230976142011246 ], [ 0, -3.230976142011246, -3.230976142011246 ] ]
[ [ -4.846464213016869, -4.846464213016869, -4.846464213016869 ], [ 0, 0, 0 ], [ -2.424907367638067, -4.037044916384425, -4.037044916384424 ], [ -4.037044916384425, -4.037044916384424, -2.424907367638067 ], [ -4.037044916384425, -2.42490736763806...
[ "Ta", "Ti", "Be", "Be", "Be", "Be" ]
0.049212
-35.675627
agm001200951
[ "Bi", "Cd", "La" ]
4
3
A2BC
BiCdLa2
[ [ 0, 0, 4.3430508 ], [ 5.36952489, 0, 0 ], [ 0, 5.36952489, 0 ] ]
[ [ 0, 0, 2.1715254 ], [ 2.684762445, 2.684762445, 2.1715254 ], [ 0, 2.684762445, 0 ], [ 2.684762445, 0, 0 ] ]
[ "Cd", "Bi", "La", "La" ]
0.080269
-17.108365
agm002210357
[ "Cs", "F", "Mg", "Rb" ]
10
4
A6B2CD
Cs2F6MgRb
[ [ -4.717416694931682, -4.717416694931682, 0 ], [ -4.717416694931682, 0, -4.717416694931682 ], [ 0, -4.717416694931682, -4.717416694931682 ] ]
[ [ -7.076125042397523, -7.076125042397523, -7.076125042397523 ], [ -2.358708347465841, -2.358708347465841, -2.358708347465841 ], [ 0, 0, 0 ], [ -4.717416694931682, -4.717416694931682, -4.717416694931682 ], [ -4.717416694931682, -2.00325505648109...
[ "Cs", "Cs", "Mg", "Rb", "F", "F", "F", "F", "F", "F" ]
0.027369
-42.572243
agm004935667
[ "Nb", "O", "Pb", "V" ]
20
4
A6B2CD
NbO6Pb2V
[ [ 0, -5.73865406, 0 ], [ -5.7756762486119015, 0, 0 ], [ -0.012504865577550817, 0, -7.995031565369191 ] ]
[ [ -2.894090557094726, 0, -3.9975157826845953 ], [ 0, -2.86932703, 0 ], [ -2.8878381243059508, 0, 0 ], [ -0.006252432788775408, -2.86932703, -3.9975157826845953 ], [ -0.06673460710961411, -5.702579560688407, -5.997140495349211 ], [ -...
[ "Nb", "Nb", "V", "V", "Pb", "Pb", "Pb", "Pb", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
0.019915
-147.088307
agm003205541
[ "F", "Hg", "Pd", "Rb" ]
10
4
A6B2CD
F6HgPdRb2
[ [ -4.498861240763071, -4.498861240763071, 0 ], [ -4.498861240763071, 0, -4.498861240763071 ], [ 0, -4.498861240763071, -4.498861240763071 ] ]
[ [ -2.2494306203815353, -2.249430620381535, -2.249430620381535 ], [ -6.748291861144606, -6.748291861144606, -6.748291861144606 ], [ -4.498861240763071, -4.498861240763071, -4.498861240763071 ], [ 0, 0, 0 ], [ -4.498861240763071, -6.8247343518942...
[ "Rb", "Rb", "Hg", "Pd", "F", "F", "F", "F", "F", "F" ]
0.057853
-37.656822
agm005675634
[ "Al", "Hg", "Li" ]
6
3
ABC
AlHgLi
[ [ 3.1514558658183867, 0, 0 ], [ 0, 4.0926686, 0 ], [ -0.21734667626921994, 0, 8.505965965428423 ] ]
[ [ 2.2088542084751044, 1.02316715, 6.4304138972695 ], [ 0.7252549810740623, 3.0695014499999997, 2.0755520681589235 ], [ 2.2721081396750473, 1.02316715, 3.6778188356348442 ], [ 0.6620010498741191, 3.0695014499999997, 4.828147129793579 ], [ 2.30859787...
[ "Li", "Li", "Al", "Al", "Hg", "Hg" ]
0.089687
-12.859362
agm005005425
[ "Nb", "Pd", "Pt", "Rh" ]
10
4
A2BCD
NbPdPt2Rh
[ [ 0, 3.95839185, 0 ], [ 6.256470008766688, 0, 0 ], [ 0.04899264631668298, 0, -6.30706282705361 ] ]
[ [ 1.5461206445326043, 0.9895979624999999, -4.7618478867294005 ], [ 4.759342010550766, 2.9687938874999995, -1.5452149403242095 ], [ 4.126655796811461, 0.9895979624999999, -5.990715755670014 ], [ 2.1788068582719102, 2.9687938874999995, -0.3163470713835957 ...
[ "Nb", "Nb", "Pd", "Pd", "Pt", "Pt", "Pt", "Pt", "Rh", "Rh" ]
0.097634
-73.658452
agm005019193
[ "Nb", "Si", "Sm", "Ta" ]
5
4
A2BCD
NbSi2SmTa
[ [ 4.04620643, 0, 0 ], [ 0, 4.04620643, 0 ], [ -2.023103215, -2.023103215, 5.87993079 ] ]
[ [ 0, 0, 0 ], [ 2.023103215, 0, 2.939965395 ], [ 0, 2.023103215, 2.939965395 ], [ 2.0231032149999995, 2.023103215, 1.2084963541372193 ], [ -8.379161401439603e-17, -8.379161401439603e-17, 4.671434435862782 ] ]
[ "Sm", "Ta", "Nb", "Si", "Si" ]
0.045582
-40.725598
agm003204602
[ "F", "Li", "Rb", "Sb" ]
10
4
A6B2CD
F6LiRb2Sb
[ [ -4.366108483150729, -4.366108483150729, 0 ], [ -4.366108483150729, 0, -4.366108483150729 ], [ 0, -4.366108483150729, -4.366108483150729 ] ]
[ [ -6.549162724726093, -6.549162724726093, -6.549162724726093 ], [ -2.1830542415753644, -2.1830542415753644, -2.1830542415753644 ], [ -4.366108483150729, -4.366108483150729, -4.366108483150729 ], [ 0, 0, 0 ], [ -4.366108483150729, -6.51662526179...
[ "Rb", "Rb", "Li", "Sb", "F", "F", "F", "F", "F", "F" ]
0.033304
-45.68157
agm005015114
[ "Nd", "O", "Pb", "Tb" ]
5
4
A2BCD
NdO2PbTb
[ [ 3.92675456, 0, 0 ], [ 0, 3.92675456, 0 ], [ -1.96337728, -1.96337728, 7.2202824 ] ]
[ [ 1.963075708206361e-17, 1.3065305954457926e-16, 2.4729826790063534 ], [ 1.9633772799999998, 1.9633772799999993, 4.80527403988774 ], [ 1.96337728, 1.96337728, 0.03822157572393832 ], [ 1.9633772799999998, 5.0028927292407843e-17, 3.562050292466328 ], [ ...
[ "Tb", "Nd", "Pb", "O", "O" ]
0.031307
-35.456168
agm003168857
[ "Al", "In", "La" ]
4
3
A2BC
AlIn2La
[ [ 4.64509989, 0, 0 ], [ 0, 4.64509989, 0 ], [ 0, 0, 4.75477727 ] ]
[ [ 0, 2.322549945, 0 ], [ 2.322549945, 0, 0 ], [ 0, 0, 2.377388635 ], [ 2.322549945, 2.322549945, 2.377388635 ] ]
[ "In", "In", "Al", "La" ]
0.07862
-15.738962
agm005000613
[ "Ga", "Ge", "H", "K" ]
10
4
A2BCD
GaGeHK2
[ [ 0, -4.23771765, 0 ], [ -6.977380521135244, 0, 0 ], [ 3.3589056831084356, 0, -9.607389466014723 ] ]
[ [ -0.10657569242432323, -1.0594294125000003, -3.9640645204626828 ], [ -1.895720694674431, -1.0594294125000003, -9.166844543528512 ], [ -3.5118991456024857, -3.1782882374999994, -5.643324945552041 ], [ -1.722754143352378, -3.1782882374999994, -0.44054492248...
[ "K", "K", "K", "K", "Ga", "Ga", "Ge", "Ge", "H", "H" ]
0.062917
-27.896849
agm005016547
[ "Ga", "Ge", "La", "Pd" ]
5
4
A2BCD
GaGe2LaPd
[ [ 4.42052065, 0, 0 ], [ 0, 4.42052065, 0 ], [ -2.210260325, -2.210260325, 5.20241747 ] ]
[ [ 0, 0, 0 ], [ 2.210260325, 0, 2.601208735 ], [ 2.210260325, 2.210260325, 1.2577165222882896 ], [ -2.4506971823058174e-17, -2.4506971823058174e-17, 3.9447009477117105 ], [ 0, 2.210260325, 2.601208735 ] ]
[ "La", "Ga", "Ge", "Ge", "Pd" ]
0.058829
-25.670168
agm005120441
[ "Cl", "Ir", "Sm" ]
4
3
A2BC
ClIrSm2
[ [ -2.0431618055995306, -3.5388600553825524, 0 ], [ -4.086323611199061, 0, 0 ], [ -2.0431618055995306, -1.1796200184608507, -7.60911819 ] ]
[ [ -2.0431618055995306, -1.179620018460851, -6.068379197273845 ], [ -2.043161805599531, -1.179620018460851, -1.4704556985582207 ], [ -6.129485416798593, -3.5388600553825524, -7.583935432894286 ], [ -4.086323611199061, -2.359240036921702, -3.8999571968482196...
[ "Sm", "Sm", "Ir", "Cl" ]
0.049836
-24.821331
agm005120449
[ "Cl", "Ir", "Tb" ]
4
3
A2BC
ClIrTb2
[ [ -2.015429704776932, -3.4908266477571885, 0 ], [ -4.030859409553864, 0, 0 ], [ -2.015429704776932, -1.1636088825857296, -7.50927315 ] ]
[ [ -6.046289114330797, -3.4908266477571894, -1.5171375778076117 ], [ -6.046289114330797, -3.490826647757189, -6.088434791438914 ], [ -2.015429704776932, -1.1636088825857298, -0.03081295070185983 ], [ -4.030859409553864, -2.3272177651714596, -3.6275018772321...
[ "Tb", "Tb", "Ir", "Cl" ]
0.097507
-24.718061
agm004999210
[ "Ag", "Ga", "Li", "Zn" ]
10
4
A2BCD
Ag2GaLiZn
[ [ 0, -4.3710485, 0 ], [ -5.543665373003303, 0, 0 ], [ 1.160806004774509, 0, -6.655390875832913 ] ]
[ [ -0.5478500185484371, -3.2782863749999995, -4.965853148432243 ], [ -3.8350093496803566, -1.092762125, -1.6895377274006695 ], [ -3.6099752441399056, -3.2782863749999995, -6.298604888188464 ], [ -0.7728841240888875, -1.092762125, -0.3567859876444483 ], ...
[ "Li", "Li", "Zn", "Zn", "Ga", "Ga", "Ag", "Ag", "Ag", "Ag" ]
0.029639
-25.321156
agm003168897
[ "Al", "In", "Sr" ]
4
3
A2BC
AlInSr2
[ [ 4.4478063758474775, 0, 0 ], [ 0, 4.82184762, 0 ], [ -2.215162623860363, 0, 6.376208818605615 ] ]
[ [ -1.9396214019512774, 0, 5.8777770045782765 ], [ 2.5072687948267625, 2.41092381, 2.102862318724434 ], [ 0.28341343242257955, 0, 3.1453632150636657 ], [ 0.2827422009738698, 2.41092381, 4.8145194443855726 ] ]
[ "Sr", "Sr", "Al", "In" ]
0.052555
-10.989861
agm005604472
[ "Ce", "K", "Te" ]
11
3
A6B3C2
Ce3K2Te6
[ [ -3.968564343438642, -6.873408370000018, 0 ], [ -3.968564343438642, 6.873408370000018, 0 ], [ 2.642783720954634, 0, -8.330066716757216 ] ]
[ [ -2.6471724829613246, -4.580560034818987, -4.165033358378608 ], [ -2.6471724829613255, 4.580560034818987, -4.165033358378608 ], [ 0, 0, 0 ], [ -3.9685643434386426, -2.2892119584828783, 0 ], [ -3.968564343438642, 2.2892119584828823, 0 ], ...
[ "K", "K", "Ce", "Ce", "Ce", "Te", "Te", "Te", "Te", "Te", "Te" ]
0
-53.321213
agm005002001
[ "As", "Cs", "H", "In" ]
10
4
A2BCD
AsCs2HIn
[ [ 0, -4.50818891, 0 ], [ -7.436176203237586, 0, 0 ], [ 2.1278339692755885, 0, -10.99948735322715 ] ]
[ [ -0.778116625382806, -1.1270472275, -4.796754230437865 ], [ -3.224095100750668, -1.1270472275, -9.966191881434165 ], [ -4.530225608579192, -3.3811416825, -6.202733122789286 ], [ -2.0842471332113304, -3.3811416825, -1.0332954717929865 ], [ -5.68710...
[ "Cs", "Cs", "Cs", "Cs", "In", "In", "As", "As", "H", "H" ]
0.073463
-27.359263
agm005017390
[ "Nd", "Pt", "Ti", "Zn" ]
5
4
A2BCD
NdPt2TiZn
[ [ 4.03725377, 0, 0 ], [ 0, 4.03725377, 0 ], [ -2.018626885, -2.018626885, 6.042359 ] ]
[ [ 0, 0, 0 ], [ 2.0186268850000006, -1.099883026323134e-16, 3.0211794999999997 ], [ -3.3203290755734473e-16, 2.018626885000001, 3.0211794999999997 ], [ 2.0186268850000006, 2.018626885, 1.3602572478225683 ], [ 1.0916588279702635e-16, 1.0916588279...
[ "Nd", "Ti", "Zn", "Pt", "Pt" ]
0.063871
-30.267656