immutable_id large_stringlengths 4 13 | elements listlengths 1 7 | nsites int64 1 20 | nelements int64 1 7 | chemical_formula_anonymous large_stringclasses 529
values | chemical_formula_reduced large_stringlengths 1 17 | lattice_vectors listlengths 3 3 | cartesian_site_positions listlengths 1 20 | species_at_sites listlengths 1 20 | dft_hull float64 0 0.1 | energy float64 -948.71 -0.22 |
|---|---|---|---|---|---|---|---|---|---|---|
agm002212225 | [
"Dy",
"Fe",
"I"
] | 6 | 3 | ABC | DyFeI | [
[
-1.9822102892279734,
-3.433288932228649,
0
],
[
-1.9822102892279734,
3.433288932228649,
0
],
[
0,
0,
-12.43610489
]
] | [
[
-1.9822102892279734,
-1.1444296440762167,
-8.351937940337978
],
[
-1.9822102892279736,
1.1444296440762165,
-4.084166949662022
],
[
-1.9822102892279736,
1.1444296440762165,
-12.401081958325635
],
[
-1.9822102892279736,
-1.1444296440762165,
-0.035022931674... | [
"I",
"I",
"Fe",
"Fe",
"Dy",
"Dy"
] | 0.008279 | -33.447891 |
agm002177749 | [
"Dy",
"Fe",
"P"
] | 5 | 3 | A2B2C | DyFe2P2 | [
[
3.82152929,
0,
0
],
[
0,
3.82152929,
0
],
[
-1.910764645,
-1.910764645,
4.74236762
]
] | [
[
1.910764645,
1.910764645,
1.2597141624270756
],
[
3.9168611690328704e-17,
3.9168611690328704e-17,
3.482653457572924
],
[
2.220446049250313e-16,
1.9107646449999998,
2.37118381
],
[
1.9107646449999998,
0,
2.37118381
],
[
0,
0,
0
]
] | [
"P",
"P",
"Fe",
"Fe",
"Dy"
] | 0 | -37.389997 |
agm003739979 | [
"Dy",
"Ga",
"Sc"
] | 6 | 3 | A4BC | DyGa4Sc | [
[
4.35065249,
0,
0
],
[
2.175326245,
3.4781084818110015,
3.789466870608685
],
[
2.175326245,
-3.4781084818110015,
3.789466870608685
]
] | [
[
0,
0,
0
],
[
2.175326245,
0,
3.789466870608685
],
[
4.35065249,
-1.6464658105628074,
2.5327732480851184
],
[
4.35065249,
-1.6464658105628076,
5.046160493132252
],
[
4.35065249,
1.6464658105628083,
5.046160493132251
],
[
4.35065249... | [
"Dy",
"Sc",
"Ga",
"Ga",
"Ga",
"Ga"
] | 0.034153 | -26.48761 |
agm002152019 | [
"Dy",
"Ge",
"Ir"
] | 6 | 3 | A3B2C | DyGe2Ir3 | [
[
0,
0,
-3.89692067
],
[
-2.8144471381611753,
-4.874765438511979,
0
],
[
-2.8144471381611753,
4.874765438511979,
0
]
] | [
[
-2.8144471381611758,
1.6249218128373264,
0
],
[
-2.8144471381611753,
-1.624921812837326,
0
],
[
-2.8144471381611753,
0,
-1.948460335
],
[
-4.221670707241763,
-2.4373827192559894,
-1.948460335
],
[
-1.4072235690805877,
-2.4373827192559894,
... | [
"Ge",
"Ge",
"Ir",
"Ir",
"Ir",
"Dy"
] | 0.06534 | -44.032332 |
agm005763077 | [
"Dy",
"Hg",
"Li"
] | 7 | 3 | A5BC | DyHg5Li | [
[
-3.2503718631988767,
-4.191154063583925,
0
],
[
-3.2503718631988767,
4.191154063583925,
0
],
[
0,
0,
-6.526262801262292
]
] | [
[
-3.2503718631988767,
0,
-3.263131400631146
],
[
0,
0,
0
],
[
-1.6251859315994384,
2.0955770317919624,
-4.924019664975422
],
[
-1.6251859315994384,
-2.0955770317919624,
-4.924019664975422
],
[
0,
0,
-3.263131400631146
],
[
-1.62518... | [
"Li",
"Dy",
"Hg",
"Hg",
"Hg",
"Hg",
"Hg"
] | 0.092915 | -9.555574 |
agm005721724 | [
"Dy",
"Ho",
"Tb"
] | 10 | 3 | A3BC | DyHo3Tb | [
[
6.433981151490202,
0,
0
],
[
3.2143116994823333,
5.811075328956971,
0
],
[
3.148050032476441,
-0.005381434985704903,
8.372235176546681
]
] | [
[
8.79601752620856,
2.056135232860689,
6.280438287556995
],
[
4.000325357240416,
3.7495586611105765,
2.091796888989686
],
[
5.69443746551946,
0.9052263095722536,
1.2836719956369742
],
[
7.101905417929516,
4.900467584399013,
7.0885631809097065
],
[
... | [
"Tb",
"Tb",
"Dy",
"Dy",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho"
] | 0.058949 | -45.367201 |
agm005985356 | [
"Dy",
"Ho",
"Tl"
] | 7 | 3 | A4B2C | Dy2HoTl4 | [
[
3.729973915004181,
3.729973915004181,
3.751747336308507
],
[
3.729973915004181,
-3.729973915004181,
-3.751747336308507
],
[
-3.729973915004181,
3.729973915004181,
-3.751747336308507
]
] | [
[
1.8649869575020908,
1.8649869575020905,
-1.8758736681542532
],
[
1.864986957502091,
1.8649869575020905,
-5.62762100446276
],
[
-1.8649869575020908,
1.864986957502091,
-1.875873668154254
],
[
1.8649869575020914,
5.594960872506271,
-1.8758736681542532
],... | [
"Tl",
"Tl",
"Tl",
"Tl",
"Ho",
"Dy",
"Dy"
] | 0.088647 | -24.796529 |
agm005700201 | [
"Dy",
"Ho",
"Tm"
] | 12 | 3 | A5B4C3 | Dy4Ho5Tm3 | [
[
6.081923084301377,
0,
0
],
[
0.013020285531210811,
7.030232591419629,
0
],
[
0.010297141737541182,
0.001957200972483647,
8.597259101864775
]
] | [
[
4.064044186292787,
1.7642259480114015,
7.161247049862744
],
[
5.083274739389902,
7.029439690883776,
1.4336787558817894
],
[
1.0219657721802273,
0.002750101508335968,
7.163580345982987
],
[
2.0411963252773417,
5.267963844380711,
1.4360120520020316
],
... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho",
"Tm",
"Tm",
"Tm"
] | 0.02594 | -54.462082 |
agm003333248 | [
"Dy",
"In",
"Nd"
] | 9 | 3 | A4B3C2 | Dy3In2Nd4 | [
[
5.40899790758516,
0,
0
],
[
-2.7033371096826277,
6.261013008096625,
0
],
[
-0.00838071862842079,
-2.194877668464567,
8.352235050957026
]
] | [
[
2.696682746981131,
-0.001478452047480043,
8.05343551245605
],
[
-0.00545285845224727,
0.012780580719811169,
5.485444878858575
],
[
2.7027329377263585,
4.0533547589122465,
2.8667901720984514
],
[
0.0005973322929805992,
4.067613791679538,
0.298799538500976... | [
"Nd",
"Nd",
"Nd",
"Nd",
"Dy",
"Dy",
"Dy",
"In",
"In"
] | 0.061241 | -40.007791 |
agm002234519 | [
"Dy",
"In",
"Pd"
] | 12 | 3 | ABC | DyInPd | [
[
0,
-4.576017710000048,
0
],
[
-6.971105590002176,
0,
0
],
[
0,
0,
-8.325753480002378
]
] | [
[
-4.544485135416581,
-3.4320132825000362,
-7.812905715322027
],
[
-1.0589323404154927,
-3.4320132825000362,
-4.67572450468154
],
[
-5.912173249586683,
-1.144004427500012,
-3.650028975320838
],
[
-2.426620454585595,
-1.144004427500012,
-0.5128477646803509
... | [
"In",
"In",
"In",
"In",
"Pd",
"Pd",
"Pd",
"Pd",
"Dy",
"Dy",
"Dy",
"Dy"
] | 0.030797 | -59.544152 |
agm003419813 | [
"Dy",
"In",
"Pr"
] | 12 | 3 | A3B2C | Dy2InPr3 | [
[
0,
-3.7549891,
0
],
[
-8.795649738278474,
0,
0
],
[
0.14372989840206485,
0,
-11.784095840384271
]
] | [
[
-7.900210185078681,
-2.816241825,
-4.683432281127009
],
[
-0.7517096547977284,
-0.938747275,
-7.100663559257264
],
[
-3.3587190861600735,
-2.816241825,
-8.843976772872862
],
[
-5.293200753716336,
-0.938747275,
-2.9401190675114086
],
[
-5.64583330... | [
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Dy",
"Dy",
"Dy",
"Dy",
"In",
"In"
] | 0.062631 | -54.05545 |
agm005911388 | [
"Dy",
"In",
"Pt"
] | 16 | 3 | A5B2C | Dy5InPt2 | [
[
7.868519510661908,
0,
0
],
[
0,
7.868519510661908,
0
],
[
-3.934259755330954,
-3.934259755330954,
6.713059320825967
]
] | [
[
1.2543212853335806,
2.6799384699973747,
4.8704603424493005
],
[
5.188581040664534,
6.614198225328328,
1.842598978376667
],
[
0,
0,
0
],
[
3.934259755330954,
3.934259755330954,
0
],
[
-1.2543212853335797,
-2.679938469997374,
4.870460342449... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"In",
"In",
"Pt",
"Pt",
"Pt",
"Pt"
] | 0.019778 | -88.795551 |
agm006092567 | [
"Dy",
"In",
"Y"
] | 20 | 3 | A6B3C | Dy3InY6 | [
[
0,
-5.56673843,
0
],
[
-9.671284464253196,
0,
0
],
[
4.367154582052529,
0,
-11.625410694389586
]
] | [
[
-1.8518927825801053,
-1.3916846075,
-7.330179040445595
],
[
-3.452237099620562,
-4.1750538225,
-4.295231653943992
],
[
-4.817081119694791,
-1.3916846075,
-2.5635420980248083
],
[
-0.48704876250587587,
-4.1750538225,
-9.061868596364778
],
[
-2.090... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"In",
"In"
] | 0.039123 | -112.282251 |
agm001093866 | [
"Dy",
"La",
"Mg"
] | 4 | 3 | A2BC | DyLa2Mg | [
[
-4.027062928448578,
-4.027062928448578,
0
],
[
-4.027062928448578,
0,
-4.027062928448578
],
[
0,
-4.027062928448578,
-4.027062928448578
]
] | [
[
-4.027062928448578,
-4.027062928448578,
-4.027062928448578
],
[
-6.040594392672867,
-6.040594392672867,
-6.040594392672867
],
[
-2.01353146422429,
-2.01353146422429,
-2.01353146422429
],
[
0,
0,
0
]
] | [
"Mg",
"La",
"La",
"Dy"
] | 0.06567 | -16.033309 |
agm003560365 | [
"Dy",
"La",
"Te"
] | 8 | 3 | A4B3C | DyLa3Te4 | [
[
0,
0,
-4.48065628
],
[
-4.570150505330612,
-6.401598880678574,
0
],
[
-4.570150505330612,
6.401598880678574,
0
]
] | [
[
-2.285075252665306,
-3.200799440339287,
0
],
[
-4.570150505330612,
0,
-2.24032814
],
[
-2.285075252665306,
3.2007994403392868,
0
],
[
0,
0,
-2.24032814
],
[
-2.177050239558765,
-7.692338875078529e-16,
0
],
[
-4.570150505330612,
... | [
"La",
"La",
"La",
"Dy",
"Te",
"Te",
"Te",
"Te"
] | 0.015691 | -44.04498 |
agm003558576 | [
"Dy",
"La",
"Tm"
] | 16 | 3 | A4B3C | DyLa3Tm4 | [
[
0,
0,
-6.29634831
],
[
0,
-7.3074325,
0
],
[
-11.50623574,
0,
0
]
] | [
[
0,
-2.70574393103195,
-2.2178698031525714
],
[
-2.88460179378226,
-2.7381487404532003,
-0.11532032672742554
],
[
-2.868516076217741,
-4.5692837595468,
-3.2634944817274256
],
[
-5.75311787,
-4.60168856896805,
-5.366043958152571
],
[
-8.63771966378... | [
"La",
"La",
"La",
"La",
"La",
"La",
"Dy",
"Dy",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm"
] | 0.037734 | -74.022081 |
agm005645299 | [
"Dy",
"Li",
"Pd"
] | 9 | 3 | A6B2C | Dy6LiPd2 | [
[
0,
-3.9586765381328615,
0
],
[
-7.053402181159042,
-1.9793382690664307,
0
],
[
-0.9612675541699307,
-1.9793382690664307,
-8.385923337556898
]
] | [
[
-4.007334867664486,
-5.938014807199293,
-4.192961668778449
],
[
-1.769439385621904,
-1.9793382690664307,
-6.867835317435613
],
[
-2.344460715406754,
-1.979338269066431,
-1.008411977458287
],
[
-5.670209019922218,
-5.938014807199292,
-7.3775113600986115
... | [
"Li",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Pd",
"Pd"
] | 0.055325 | -43.191052 |
agm005113900 | [
"Dy",
"Na",
"S"
] | 4 | 3 | A2BC | DyNaS2 | [
[
-1.9770316237968286,
-3.4243192205865056,
0
],
[
-3.9540632475936572,
0,
0
],
[
-1.9770316237968286,
-1.1414397401955019,
-6.94131388
]
] | [
[
-3.9540632475936577,
-2.282879480391004,
-3.541714684297593
],
[
-5.931094871390486,
-3.424319220586506,
-6.918277255734476
],
[
-1.9770316237968288,
-1.1414397401955019,
-5.37986719684875
],
[
-1.9770316237968286,
-1.141439740195502,
-1.513418621805314
... | [
"Na",
"Dy",
"S",
"S"
] | 0.04092 | -21.413504 |
agm005747869 | [
"Dy",
"Nd",
"Sc"
] | 6 | 3 | A4BC | DyNd4Sc | [
[
-3.1096509258275353,
-5.362158625280025,
0
],
[
-3.1096509258275353,
5.362158625280025,
0
],
[
2.040987511187054,
0,
-5.870303903484442
]
] | [
[
-3.1096509258275353,
1.7840074944030246,
0
],
[
-3.1096509258275358,
-1.7840074944030242,
0
],
[
-2.089157170234008,
-3.6164792508930588,
-2.935151951742221
],
[
-2.089157170234008,
3.616479250893057,
-2.935151951742221
],
[
-2.0891571702340084,
... | [
"Nd",
"Nd",
"Nd",
"Nd",
"Dy",
"Sc"
] | 0.036791 | -29.791559 |
agm002232401 | [
"Dy",
"Ni",
"P"
] | 10 | 3 | A2B2C | DyNi2P2 | [
[
3.97983756,
0,
0
],
[
0,
3.97983756,
0
],
[
0,
0,
9.06488447
]
] | [
[
1.98991878,
0,
7.992499934909912
],
[
0,
1.98991878,
1.0723845350900894
],
[
0,
0,
4.532442235
],
[
1.98991878,
1.98991878,
4.532442235
],
[
1.98991878,
0,
5.721169032683015
],
[
0,
1.98991878,
3.343715437316986
],
[
... | [
"Ni",
"Ni",
"Ni",
"Ni",
"P",
"P",
"P",
"P",
"Dy",
"Dy"
] | 0.023981 | -63.894063 |
agm005728977 | [
"Dy",
"Ni",
"Sc"
] | 16 | 3 | A2BC | Dy2NiSc | [
[
0,
0,
6.2403884
],
[
6.66790136,
0,
0
],
[
0,
9.24560095,
0
]
] | [
[
4.577642507383154,
0.5848996451873559,
1.1339893391740998
],
[
1.243691827383153,
4.037900829812644,
1.9862048608258998
],
[
2.090258852616847,
5.207700120187356,
5.1063990608259
],
[
5.424209532616847,
8.660701304812644,
4.254183539174099
],
[
2... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Sc",
"Sc",
"Sc",
"Sc",
"Ni",
"Ni",
"Ni",
"Ni"
] | 0.016883 | -89.128833 |
agm005682774 | [
"Dy",
"Ni",
"Tm"
] | 18 | 3 | A4B3C2 | Dy2Ni4Tm3 | [
[
0,
-7.2073514,
0
],
[
-7.279623961978773,
0,
0
],
[
2.17013324133333,
0,
-7.123997825419113
]
] | [
[
-0.17020570315659067,
-4.89466405048697,
-4.232626065402448
],
[
-3.854218396822187,
-1.2909883504869692,
-6.453370672726221
],
[
-4.939285017488852,
-2.31268734951303,
-2.8913717600166655
],
[
-1.2552723238232546,
-5.916363049513031,
-0.6706271526928923... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni"
] | 0.024172 | -98.997399 |
agm005571565 | [
"Dy",
"Os",
"Te"
] | 11 | 3 | A7B2C2 | Dy7Os2Te2 | [
[
-3.993259622468534,
0,
0
],
[
0,
0,
-9.32030137779217
],
[
1.996629811234267,
-7.91847496729122,
4.660150688896085
]
] | [
[
-1.7410096393919836e-17,
-2.927044237917533,
-0.9652193115719723
],
[
-4.532261696026624e-18,
-2.38929925674804,
-6.875324612334592
],
[
-1.996629811234267,
0,
-9.100267330053194
],
[
-1.0338898746714135e-17,
-5.812613800314135,
0.9905148891203451
],
... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Te",
"Te",
"Os",
"Os"
] | 0 | -68.230564 |
agm005690016 | [
"Dy",
"P",
"Sm"
] | 9 | 3 | A4B3C2 | Dy3P4Sm2 | [
[
0,
-4.00950643550806,
0
],
[
-6.634389157096273,
-2.00475321775403,
0
],
[
-1.8644175809388157,
-2.00475321775403,
-8.58712159982716
]
] | [
[
-2.4032606357259647,
-4.00950643550806,
-5.19400757306848
],
[
-6.095546102309124,
-4.00950643550806,
-3.3931140267586803
],
[
0,
0,
0
],
[
-3.0166134146182593,
-2.00475321775403,
-1.6356721744561649
],
[
-5.482193323416832,
-6.01425965326209... | [
"Sm",
"Sm",
"Dy",
"Dy",
"Dy",
"P",
"P",
"P",
"P"
] | 0.008295 | -57.666142 |
agm005834099 | [
"Dy",
"Pb",
"Sb"
] | 6 | 3 | A3B2C | Dy3PbSb2 | [
[
4.317770812983332,
0,
0
],
[
0,
6.237202565158484,
0
],
[
-2.158885406491666,
-3.118601282579242,
6.730605533634436
]
] | [
[
1.6814117498322506e-17,
2.1187571906456813e-17,
4.403972639622007
],
[
0,
0,
0
],
[
2.158885406491666,
3.1186012825792413,
2.326632894012428
],
[
2.158885406491666,
-3.9022308009004975e-17,
2.2283344866814123
],
[
-8.727550485821629e-17,
3.11... | [
"Dy",
"Dy",
"Dy",
"Sb",
"Sb",
"Pb"
] | 0.062144 | -30.921603 |
agm003678490 | [
"Dy",
"Pb",
"Tm"
] | 12 | 3 | A6B5C | DyPb6Tm5 | [
[
6.067300311880019,
0,
0
],
[
1.7917923411626442,
0,
-7.426509135386493
],
[
3.0336501559400095,
7.62513231,
0
]
] | [
[
0,
0,
0
],
[
6.96319648246134,
5.111244300692483,
-3.7132545676932467
],
[
3.033650155940009,
2.558517146204716,
0
],
[
6.963196482461341,
0,
-3.7132545676932467
],
[
6.067300311880018,
5.066615163795284,
0
],
[
3.9295463265213315... | [
"Dy",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Pb",
"Pb",
"Pb",
"Pb",
"Pb",
"Pb"
] | 0.077744 | -53.847357 |
agm003629654 | [
"Dy",
"Pd",
"Sb"
] | 8 | 3 | A2BC | Dy2PdSb | [
[
0,
-4.3083466,
0
],
[
-6.1128540481065405,
0,
0
],
[
2.999099107408054,
0,
-7.658606914171806
]
] | [
[
-2.98397050222328,
-1.07708665,
-4.2648515723236855
],
[
-0.12978443847520624,
-3.23125995,
-3.3937553418481197
],
[
-1.4426938109080372,
-3.23125995,
-6.957677500480425
],
[
-1.6710611297904492,
-1.07708665,
-0.7009294136913795
],
[
1.6763966358... | [
"Dy",
"Dy",
"Dy",
"Dy",
"Sb",
"Sb",
"Pd",
"Pd"
] | 0.069807 | -44.715378 |
agm003626254 | [
"Dy",
"Pd",
"Y"
] | 4 | 3 | A2BC | DyPd2Y | [
[
0,
-3.765253512443865,
0
],
[
-4.53358211,
0,
0
],
[
0,
1.8826267562219325,
-5.289320751081738
]
] | [
[
-2.266791055,
1.0843802220549506e-16,
-4.713107755138888
],
[
0,
-1.8826267562219325,
-2.3354444629179136
],
[
-2.266791055,
4.485052697724311e-17,
-1.7816773343007717
],
[
0,
-1.8826267562219325,
-5.253533682918785
]
] | [
"Dy",
"Y",
"Pd",
"Pd"
] | 0.007512 | -25.095885 |
agm003552487 | [
"Dy",
"Pr",
"Sm"
] | 16 | 3 | A4B3C | Dy3PrSm4 | [
[
0,
0,
-6.33585801
],
[
0,
-7.33572198,
0
],
[
-11.56352209,
0,
0
]
] | [
[
0,
-4.58549085391139,
-5.402406820345317
],
[
-5.781761045,
-2.7502311260886114,
-2.234477815345318
],
[
0,
-0.9305134457104239,
-5.4118266572416855
],
[
0,
-6.409337078619922,
-2.215799579214678
],
[
-2.922171528910761,
-6.417041934129955,
... | [
"Pr",
"Pr",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy",
"Dy"
] | 0.027425 | -74.513232 |
agm003404851 | [
"Dy",
"Pt",
"Sc"
] | 5 | 3 | A2B2C | Dy2Pt2Sc | [
[
4.11543441,
0,
0
],
[
2.057717205,
3.175080955442226,
4.35166369019005
],
[
2.057717205,
-3.175080955442226,
4.35166369019005
]
] | [
[
2.0577172049999994,
-1.9917272630751244e-16,
2.6090873115543936
],
[
6.173151615,
-3.1014658016907453e-16,
6.094240068825707
],
[
0,
0,
0
],
[
4.11543441,
-1.4160432425343348,
4.35166369019005
],
[
4.11543441,
1.4160432425343346,
4.351663... | [
"Dy",
"Dy",
"Sc",
"Pt",
"Pt"
] | 0.077529 | -32.758394 |
agm001185601 | [
"Dy",
"Pt",
"Tb"
] | 6 | 3 | A4BC | DyPt4Tb | [
[
-3.8467125110067695,
-3.8467125110067695,
0
],
[
-3.8467125110067695,
0,
-3.8467125110067695
],
[
0,
-3.8467125110067695,
-3.8467125110067695
]
] | [
[
0,
0,
0
],
[
-2.88541230993691,
-4.80801271207663,
-4.808012712076629
],
[
-4.80801271207663,
-4.808012712076629,
-2.8854123099369082
],
[
-2.88541230993691,
-2.88541230993691,
-2.885412309936909
],
[
-4.80801271207663,
-2.8854123099369087,
... | [
"Tb",
"Pt",
"Pt",
"Pt",
"Pt",
"Dy"
] | 0.006171 | -40.139184 |
agm001100765 | [
"Dy",
"Pt",
"Y"
] | 4 | 3 | A2BC | DyPt2Y | [
[
-3.5005445950384573,
-3.5005445950384573,
0
],
[
-3.5005445950384573,
0,
-3.5005445950384573
],
[
0,
-3.5005445950384573,
-3.5005445950384573
]
] | [
[
-3.500544595038457,
-3.5005445950384573,
-3.500544595038457
],
[
-5.250816892557686,
-5.250816892557686,
-5.250816892557686
],
[
-1.7502722975192282,
-1.7502722975192282,
-1.7502722975192277
],
[
0,
0,
0
]
] | [
"Y",
"Pt",
"Pt",
"Dy"
] | 0.074306 | -27.99346 |
agm006125386 | [
"Dy",
"Ru",
"Tb"
] | 10 | 3 | A5B4C | DyRu4Tb5 | [
[
0,
-4.8531895413926,
0
],
[
-0.013043840701296489,
0,
6.733050716750528
],
[
-7.21503043819711,
2.4265947706963,
0
]
] | [
[
-4.814421863892145,
-2.4265947706963003,
0.000009493601509623657
],
[
-4.819132132258491,
-2.4265947706962994,
3.370578856898271
],
[
-2.4089421466399177,
-5.632553973858885e-16,
3.3624718598522567
],
[
-0.006521920350649046,
-2.4265947706963003,
3.36652... | [
"Tb",
"Tb",
"Tb",
"Tb",
"Tb",
"Dy",
"Ru",
"Ru",
"Ru",
"Ru"
] | 0.087351 | -67.443028 |
agm005107820 | [
"Dy",
"Sc",
"Y"
] | 4 | 3 | A2BC | DySc2Y | [
[
-1.726429719840454,
-2.990263990460569,
0
],
[
-3.452859439680908,
0,
0
],
[
-1.726429719840454,
-0.9967546634868563,
-10.903565449999999
]
] | [
[
-3.452859439680908,
-1.993509326973713,
-5.465579115399536
],
[
-3.452859439680908,
-1.9935093269737127,
-10.89132467128321
],
[
-5.179289159521362,
-2.9902639904605692,
-2.744853098960162
],
[
-5.179289159521362,
-2.990263990460569,
-8.15716677063729
... | [
"Dy",
"Y",
"Sc",
"Sc"
] | 0.059332 | -23.500681 |
agm002193157 | [
"Dy",
"Zn",
"Zr"
] | 4 | 3 | A2BC | DyZn2Zr | [
[
-3.4505882971848307,
-3.4505882971848307,
0
],
[
-3.4505882971848307,
0,
-3.4505882971848307
],
[
0,
-3.4505882971848307,
-3.4505882971848307
]
] | [
[
-1.7252941485924154,
-1.7252941485924154,
-1.7252941485924154
],
[
-5.175882445777246,
-5.175882445777246,
-5.175882445777246
],
[
-3.4505882971848307,
-3.4505882971848307,
-3.4505882971848307
],
[
0,
0,
0
]
] | [
"Zn",
"Zn",
"Zr",
"Dy"
] | 0.066592 | -16.667827 |
agm002271719 | [
"Er",
"Fe",
"In"
] | 11 | 3 | A5B4C2 | Er4Fe2In5 | [
[
0,
-3.61855157,
0
],
[
-7.637087808686322,
0,
0
],
[
0.9213845024173272,
0,
-9.339608153624921
]
] | [
[
-3.9271617242020036,
0,
-3.0688321697227856
],
[
-1.1063873839468539,
0,
-1.3474841078548343
],
[
-3.818543904343161,
0,
0
],
[
-5.60931592232214,
0,
-7.992124045770087
],
[
-2.788541582066991,
0,
-6.270775983902135
],
[
0.0823639... | [
"In",
"In",
"In",
"In",
"In",
"Fe",
"Fe",
"Er",
"Er",
"Er",
"Er"
] | 0.066403 | -52.087801 |
agm005612473 | [
"Er",
"Ga",
"Tb"
] | 12 | 3 | A3B2C | ErGa2Tb3 | [
[
-4.9809927,
0,
0
],
[
0,
0,
-6.54076198
],
[
0,
-9.46515218,
0
]
] | [
[
0,
-9.018686441457664,
-3.4695751213446546
],
[
0,
-0.44646573854233684,
-0.19919413134465536
],
[
-2.49049635,
-1.6990448869650328,
-2.103522134291962
],
[
-2.49049635,
-7.766107293034968,
-5.373903124291961
],
[
0,
-3.079920671081322,
-... | [
"Tb",
"Tb",
"Tb",
"Tb",
"Tb",
"Tb",
"Er",
"Er",
"Ga",
"Ga",
"Ga",
"Ga"
] | 0.024232 | -54.119567 |
agm002246030 | [
"Er",
"Ga",
"Zn"
] | 5 | 3 | A2B2C | ErGa2Zn2 | [
[
4.08337056438065,
0,
0
],
[
0,
4.08337056438065,
0
],
[
-2.041685282190325,
-2.041685282190325,
5.456225881786699
]
] | [
[
2.0416852821903255,
2.041685282190325,
1.1843369561752541
],
[
-1.5261267543732323e-16,
6.943192948770808e-17,
4.271888925611444
],
[
2.0416852821903246,
0,
2.7281129408933493
],
[
2.220446049250313e-16,
2.0416852821903246,
2.7281129408933493
],
[
... | [
"Zn",
"Zn",
"Ga",
"Ga",
"Er"
] | 0.039061 | -15.016979 |
agm001258847 | [
"Er",
"Ge",
"Pd"
] | 3 | 3 | ABC | ErGePd | [
[
0,
0,
-3.49207172
],
[
-2.2034875498071074,
-3.816552390111367,
0
],
[
-2.2034875498071074,
3.816552390111367,
0
]
] | [
[
0,
0,
-1.74603586
],
[
-2.203487549807108,
1.2721841300371222,
-1.74603586
],
[
-2.2034875498071074,
-1.2721841300371226,
0
]
] | [
"Ge",
"Pd",
"Er"
] | 0.030866 | -17.240955 |
agm002277033 | [
"Er",
"Ge",
"Pt"
] | 10 | 3 | A2B2C | Er2Ge2Pt | [
[
4.315172030011367,
0,
0
],
[
2.1528658378817287,
5.204118612883887,
0
],
[
2.147529258146905,
-0.5181071605780334,
9.1708037922318
]
] | [
[
2.155635599226621,
0.82202380000194,
1.0290071965581926
],
[
6.465987634010885,
3.5676983717515247,
4.08383825613362
],
[
6.45993152681338,
3.8639876523039134,
8.141796595673608
],
[
2.149579492029117,
1.118313080554329,
5.086965536098179
],
[
4.... | [
"Ge",
"Ge",
"Ge",
"Ge",
"Pt",
"Pt",
"Er",
"Er",
"Er",
"Er"
] | 0.019235 | -58.928697 |
agm001968103 | [
"Er",
"Ho",
"Mg"
] | 4 | 3 | A2BC | ErHo2Mg | [
[
-1.7464373448075379,
-3.0249182134423416,
0
],
[
-3.4928746896150757,
0,
0
],
[
-1.7464373448075379,
-1.0083060711474472,
-11.1209644
]
] | [
[
-1.7464373448075383,
-3.0249182134423416,
-1.234675073291669e-15
],
[
-5.239312034422614,
-3.0249182134423416,
-8.414933940279775
],
[
-1.746437344807538,
-1.0083060711474474,
-2.706030459720224
],
[
-3.4928746896150766,
-2.016612142294895,
-5.5604822000... | [
"Mg",
"Ho",
"Ho",
"Er"
] | 0.067753 | -15.235836 |
agm005904144 | [
"Er",
"Ho",
"Ni"
] | 10 | 3 | A2B2C | ErHo2Ni2 | [
[
0,
-5.66051844,
0
],
[
-5.716255948577001,
2.83025922,
0
],
[
1.2919442205175853,
0,
-6.951157084714825
]
] | [
[
-2.7817706321137345,
0.6241093193135574,
-5.87378543118783
],
[
-0.9965689856868898,
-2.2061499006864422,
-4.552950195884407
],
[
-1.6425410959456832,
-3.4543685393135575,
-1.0773716535269953
],
[
-3.427742742372526,
-0.6241093193135581,
-2.3982068888304... | [
"Ho",
"Ho",
"Ho",
"Ho",
"Er",
"Er",
"Ni",
"Ni",
"Ni",
"Ni"
] | 0.050944 | -53.985578 |
agm005649622 | [
"Er",
"Ho",
"Sm"
] | 12 | 3 | A5B5C2 | Er5Ho5Sm2 | [
[
0,
-4.991813022802685,
0
],
[
-7.494562463181382,
-2.4959065114013423,
0
],
[
-2.500274101068876,
-2.4959065114013423,
-9.9951355375862
]
] | [
[
-4.9979388580893085,
-7.487719534204027,
-7.490472914271862
],
[
-4.996897706160948,
-2.4959065114013423,
-2.5046626233143385
],
[
-4.997418282125128,
-4.991813022802685,
-4.9975677687931
],
[
-2.493818738409599,
-2.495906511401342,
-0.000866478299753906... | [
"Sm",
"Sm",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho",
"Er",
"Er",
"Er",
"Er",
"Er"
] | 0.028417 | -54.885269 |
agm005770693 | [
"Er",
"Ho",
"Tl"
] | 8 | 3 | A6BC | ErHoTl6 | [
[
4.75489689,
0,
0
],
[
0,
4.75489689,
0
],
[
0,
0,
9.51312105
]
] | [
[
0,
0,
4.756560525
],
[
0,
0,
0
],
[
2.377448445,
2.377448445,
0
],
[
2.377448445,
2.377448445,
4.756560525
],
[
2.377448445,
0,
2.3741411986623557
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[
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0,
7.138979851337645
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[
0,
2.377448445,
... | [
"Ho",
"Er",
"Tl",
"Tl",
"Tl",
"Tl",
"Tl",
"Tl"
] | 0.000028 | -25.010162 |
agm003408016 | [
"Er",
"Ho",
"Y"
] | 12 | 3 | A3B2C | Er2Ho3Y | [
[
0,
-3.61155199,
0
],
[
-10.8999752594547,
-1.805775995,
0
],
[
-5.189710629423586,
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] | [
[
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[
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[
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[
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[... | [
"Y",
"Y",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho",
"Ho",
"Er",
"Er",
"Er",
"Er"
] | 0.007874 | -58.631773 |
agm002243439 | [
"Er",
"I",
"Sn"
] | 5 | 3 | A2B2C | Er2I2Sn | [
[
-2.177003170286112,
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0
],
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-2.177003170286112,
3.770680099174066,
0
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[
0,
0,
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[
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[
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[
-2.177003170286112,
1.25... | [
"I",
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"Sn",
"Er",
"Er"
] | 0.022873 | -21.494154 |
agm005895444 | [
"Er",
"In",
"Nd"
] | 12 | 3 | A9B2C | Er9In2Nd | [
[
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0,
0
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[
0,
4.84222369,
0
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[
0,
0,
14.87609155
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2.421111845,
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[
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[
2.421111845,
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[
... | [
"Nd",
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"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"In",
"In"
] | 0.021472 | -53.196126 |
agm003737603 | [
"Er",
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"Tm"
] | 12 | 3 | A4BC | Er4InTm | [
[
4.83837319,
0,
0
],
[
-2.419186595,
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0
],
[
0,
0,
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[
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[
2.419186595,
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[
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[
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7.235680944313279,
5.405240929134028
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[
... | [
"Er",
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"Er",
"Er",
"Er",
"Er",
"Er",
"Tm",
"Tm",
"In",
"In"
] | 0.065266 | -52.323822 |
agm005607214 | [
"Er",
"La",
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] | 12 | 3 | A7B3C2 | Er2La7Pr3 | [
[
0,
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0
],
[
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0,
0
],
[
1.882182166687805,
0,
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[
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[
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[
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0,
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[
-1.13258... | [
"La",
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"La",
"La",
"La",
"La",
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"Pr",
"Er",
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] | 0.06948 | -57.15151 |
agm005768432 | [
"Er",
"La",
"Sc"
] | 8 | 3 | A6BC | ErLa6Sc | [
[
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0,
0
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[
0,
5.14769284,
0
],
[
0,
0,
10.29213349
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[
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[
0,
2.57384642,
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[
0,
2.57384642,
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]... | [
"La",
"La",
"La",
"La",
"La",
"La",
"Er",
"Sc"
] | 0.021626 | -40.297984 |
agm006045295 | [
"Er",
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"Sm"
] | 20 | 3 | A15B4C | Er4LaSm15 | [
[
5.108704,
0,
0
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[
0,
5.108704,
0
],
[
0,
0,
25.52797607
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2.554352,
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2.554352,
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[
2.554352,
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[
... | [
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"Sm",
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"Er",
"Er",
"Er",
"Er"
] | 0.020278 | -93.599205 |
agm005902181 | [
"Er",
"La",
"Tb"
] | 12 | 3 | A9B2C | ErLa2Tb9 | [
[
5.075659095,
0,
0
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[
0,
5.075659095,
0
],
[
0,
0,
15.24708334
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] | [
[
0,
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[
0,
0,
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[
2.5378295475,
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0
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[
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[
2.5378295475,
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10.201914945294039
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[
2.5378295475,
0,
2.482646444... | [
"La",
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"Tb",
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"Tb",
"Tb",
"Tb",
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] | 0.028316 | -55.767375 |
agm003438318 | [
"Er",
"La",
"Zn"
] | 6 | 3 | A3B2C | ErLa3Zn2 | [
[
3.76865316,
0,
0
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[
0,
3.76865316,
0
],
[
0,
0,
12.35121802
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[
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[
0,
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[
0,
0,
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[
1.88432658,
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[
1.88432658,
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10.45751284605363
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[
1.88432658,
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1.8937051739463697
]
] | [
"La",
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"Zn",
"Zn"
] | 0.034722 | -23.015746 |
agm002284095 | [
"Er",
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] | 4 | 3 | A2BC | Er2LiNi | [
[
-3.4472632901200284,
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0
],
[
-3.4472632901200284,
0,
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[
0,
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[
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[
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[
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[
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]
] | [
"Ni",
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"Er"
] | 0.088866 | -17.489227 |
agm005970509 | [
"Er",
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] | 7 | 3 | A4B2C | ErLi2Zn4 | [
[
0,
0,
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[
-3.4488902122819005,
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[
-3.4488902122819005,
3.4488902122819005,
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] | [
[
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[
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[
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[
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2.1236830... | [
"Li",
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"Zn",
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] | 0.002272 | -15.470792 |
agm003427736 | [
"Er",
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] | 12 | 3 | A3B2C | ErMg2Pb3 | [
[
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0,
0
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[
0,
0,
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[
0,
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0
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[
0,
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[
0,
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[
0,
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[
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[
0,
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-4.0965372187... | [
"Er",
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"Mg",
"Mg",
"Mg",
"Pb",
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] | 0.045631 | -39.813388 |
agm003532780 | [
"Er",
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"Pd"
] | 11 | 3 | A8B2C | ErMg2Pd8 | [
[
0,
4.11276446,
0
],
[
1.8048669421519403,
0,
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],
[
-7.178062157364779,
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0
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] | [
[
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0
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[
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[
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[
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[
-... | [
"Er",
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"Pd",
"Pd",
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"Pd",
"Pd"
] | 0.045937 | -56.147197 |
agm005820593 | [
"Er",
"Mn",
"V"
] | 19 | 3 | A16B2C | Er2Mn16V | [
[
4.316486802533159,
2.492124817395986,
3.879662856394701
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[
-4.316486802533159,
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[
0,
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] | [
[
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[
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[
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[
-1.1917839917633355,
2.9098122636385155,
7.75439... | [
"Er",
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"Mn",
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"V"
] | 0.017208 | -165.307338 |
agm005805081 | [
"Er",
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"Zn"
] | 18 | 3 | A6B2C | Er6Mn2Zn | [
[
4.682690318805293,
4.720694618622764,
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[
4.682690318805293,
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[
-4.682690318805293,
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] | [
[
2.942837105468412,
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[
1.7398532133368805,
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[
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[
1.7398532133368805,
6.8038237627362514,
2.0768245050779194e... | [
"Er",
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"Mn",
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"Zn",
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] | 0.052924 | -94.511434 |
agm003536807 | [
"Er",
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] | 12 | 3 | A9B2C | Er9NdPr2 | [
[
0,
0,
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[
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0
],
[
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[
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[
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[
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0,
0
],
[
-8.444019029983343,
4.8751566600032055,
... | [
"Pr",
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"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er"
] | 0.072138 | -54.571772 |
agm005785827 | [
"Er",
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"Pr"
] | 16 | 3 | A14BC | Er14NdPr | [
[
0,
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],
[
0,
-3.552126927795727,
6.132878325622807
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[
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] | [
[
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[
0,
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[
0,
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[
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"Er",
"Er",
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] | 0.014352 | -73.242642 |
agm005554555 | [
"Er",
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] | 7 | 3 | A3B2C2 | Er2Nd2S3 | [
[
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0,
0
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[
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0
],
[
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] | [
[
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[
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[
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[
0.004265173527109776,
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],
... | [
"Nd",
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"S",
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] | 0.01924 | -42.964801 |
agm005873378 | [
"Er",
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] | 7 | 3 | A4B2C | Er2NdTb4 | [
[
0,
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0
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[
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1.7659433233808028,
0
],
[
4.270999878145095,
0,
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] | [
[
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[
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[
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[
1.2119715086511709,
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-6.35015111... | [
"Tb",
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] | 0.035892 | -32.186513 |
agm005609820 | [
"Er",
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] | 12 | 3 | A7B3C2 | Er3Nd7Tb2 | [
[
0,
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0
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[
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0,
0
],
[
1.791682300201796,
0,
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] | [
[
0.8156993633751304,
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[
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[
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[
-3.8956284015894123,
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[
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"Tb",
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] | 0.072092 | -55.499887 |
agm005654547 | [
"Er",
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"Y"
] | 19 | 3 | A12B5C2 | Er2Nd5Y12 | [
[
6.337066781116862,
0,
0
],
[
1.8228178063351785,
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0
],
[
2.138570613467881,
3.7444440628696545,
11.348373491589902
]
] | [
[
2.9616257763688676,
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[
3.990356473826138,
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[
1.9806942099015297,
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],
[
6.3080987270937845,
3.3417129565941943,
5.572066250739915
],
[
... | [
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"Y",
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"Y",
"Y",
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] | 0.064848 | -109.477598 |
agm002233270 | [
"Er",
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] | 6 | 3 | ABC | ErNiP | [
[
3.8541687403871094,
0,
0
],
[
0,
3.8541687403871094,
0
],
[
-1.9270843701935547,
-1.9270843701935547,
6.714892618096545
]
] | [
[
3.699369125713738e-17,
1.9270843701935547,
5.551471934659369
],
[
3.699369125713738e-17,
3.699369125713738e-17,
2.1940256256110957
],
[
-1.2532102628526824e-16,
9.672357863976307e-17,
4.442727667258598
],
[
1.9270843701935547,
-2.037016965271458e-17,
1.0... | [
"Ni",
"Ni",
"P",
"P",
"Er",
"Er"
] | 0.003468 | -38.820317 |
agm005904005 | [
"Er",
"Ni",
"Tm"
] | 10 | 3 | A2B2C | ErNi2Tm2 | [
[
-3.6234546333466295,
0,
0
],
[
0,
0,
-4.08447569
],
[
1.8117273166733148,
-15.080057363016175,
0
]
] | [
[
-1.8117273166733145,
-3.6796841939472764,
-1.0211189225
],
[
2.3625973876151566e-17,
-11.400373169068898,
-3.0633567674999997
],
[
-1.8117273166733148,
-13.647660018321245,
-1.0211189225
],
[
-1.1989316493437494e-17,
-1.432397344694929,
-3.06335676749999... | [
"Er",
"Er",
"Tm",
"Tm",
"Tm",
"Tm",
"Ni",
"Ni",
"Ni",
"Ni"
] | 0.087855 | -53.372894 |
agm001134956 | [
"Er",
"Ni",
"Zn"
] | 4 | 3 | A2BC | Er2NiZn | [
[
3.42978956,
0,
0
],
[
0,
3.42978956,
0
],
[
0,
0,
6.91194687
]
] | [
[
1.71489478,
1.71489478,
0
],
[
1.71489478,
1.71489478,
3.455973435
],
[
0,
0,
5.296107181660437
],
[
0,
0,
1.6158396883395632
]
] | [
"Ni",
"Zn",
"Er",
"Er"
] | 0.016623 | -17.786654 |
agm002350112 | [
"Er",
"P",
"Rh"
] | 12 | 3 | ABC | ErPRh | [
[
-2.019578442943688,
-3.4980124730493105,
0
],
[
-2.019578442943688,
3.4980124730493105,
0
],
[
0,
0,
-15.53118955
]
] | [
[
-2.0195784429436885,
1.1660041576831035,
-13.596548010887515
],
[
-2.019578442943688,
-1.1660041576831035,
-5.830953235887515
],
[
-2.019578442943688,
-1.1660041576831028,
-1.9346415391124854
],
[
-2.0195784429436876,
1.1660041576831033,
-9.7002363141124... | [
"P",
"P",
"P",
"P",
"Rh",
"Rh",
"Rh",
"Rh",
"Er",
"Er",
"Er",
"Er"
] | 0.039358 | -83.973852 |
agm001187967 | [
"Er",
"Pd",
"Zn"
] | 6 | 3 | A4BC | ErPdZn4 | [
[
-3.6672579223342088,
-3.6672579223342088,
0
],
[
-3.6672579223342088,
0,
-3.6672579223342088
],
[
0,
-3.6672579223342088,
-3.6672579223342088
]
] | [
[
-2.7446031623706366,
-4.589912682297781,
-4.589912682297781
],
[
-4.589912682297781,
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-2.7446031623706366
],
[
-2.7446031623706366,
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-2.7446031623706366
],
[
-4.589912682297781,
-2.7446031623706366,
-4.5899126822977... | [
"Zn",
"Zn",
"Zn",
"Zn",
"Pd",
"Er"
] | 0.068235 | -17.173594 |
agm005949305 | [
"Er",
"Pd",
"Zn"
] | 8 | 3 | A4B3C | ErPd4Zn3 | [
[
-2.23042394663611,
-3.8632075979920373,
0
],
[
-4.46084789327222,
0,
0
],
[
-2.23042394663611,
-1.2877358659973457,
-7.477495385254547
]
] | [
[
-6.69127183990833,
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-5.563771093086838
],
[
-2.2304239466361104,
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],
[
-4.46084789327222,
-2.5754717319946923,
-3.7387476926272734
],
[
-2.2304239466361104,
-1.287735865997346,
-4.596072373753296... | [
"Zn",
"Zn",
"Zn",
"Pd",
"Pd",
"Pd",
"Pd",
"Er"
] | 0.03375 | -34.306727 |
agm006050359 | [
"Er",
"Pr",
"Tb"
] | 20 | 3 | A15B4C | Er4Pr15Tb | [
[
5.18970154,
0,
0
],
[
0,
5.18970154,
0
],
[
0,
0,
25.81841122
]
] | [
[
0,
0,
0
],
[
2.59485077,
2.59485077,
0
],
[
2.59485077,
2.59485077,
5.171312100883735
],
[
2.59485077,
2.59485077,
10.32655198259891
],
[
2.59485077,
2.59485077,
15.491859237401094
],
[
2.59485077,
2.59485077,
20.647099119... | [
"Tb",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Er",
"Er",
"Er",
"Er"
] | 0.012896 | -94.388351 |
agm005912325 | [
"Er",
"Pr",
"Tl"
] | 16 | 3 | A12B3C | Er12Pr3Tl | [
[
4.96286606,
0,
0
],
[
0,
4.96286606,
0
],
[
0,
0,
20.10218774
]
] | [
[
0,
0,
4.991524987359437
],
[
0,
0,
10.05109387
],
[
0,
0,
15.110662752640566
],
[
2.48143303,
2.48143303,
0
],
[
2.48143303,
2.48143303,
4.8750643698408895
],
[
2.48143303,
2.48143303,
10.05109387
],
[
2.48143303,
... | [
"Pr",
"Pr",
"Pr",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Tl"
] | 0.041885 | -71.672838 |
agm001124546 | [
"Er",
"Pr",
"Y"
] | 4 | 3 | A2BC | ErPr2Y | [
[
3.64950936,
0,
0
],
[
0,
3.64950936,
0
],
[
0,
0,
10.13564204
]
] | [
[
0,
0,
7.62676139666136
],
[
0,
0,
2.508880643338641
],
[
1.82475468,
1.82475468,
5.06782102
],
[
1.82475468,
1.82475468,
0
]
] | [
"Pr",
"Pr",
"Y",
"Er"
] | 0.026602 | -20.505335 |
agm005678668 | [
"Er",
"Pt",
"Tb"
] | 18 | 3 | A4B3C2 | Er3Pt4Tb2 | [
[
2.555954674269183,
0,
-7.1008171374609965
],
[
-7.614801075577022,
0,
0
],
[
0,
7.6571378,
0
]
] | [
[
-5.049194036630164,
2.4559999196535642,
-3.0265960581996465
],
[
-1.287629701812267,
6.284568819653565,
-0.5238125105308525
],
[
-0.009652364677675693,
5.201137880346436,
-4.074221079261351
],
[
-3.771216699495572,
1.372568980346435,
-6.577004626930146
... | [
"Tb",
"Tb",
"Tb",
"Tb",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt"
] | 0 | -115.872174 |
agm005841177 | [
"Er",
"Ru",
"Zn"
] | 6 | 3 | A3B2C | Er2RuZn3 | [
[
4.590270206834864,
2.655280072355574,
0
],
[
4.590270206834864,
-2.655280072355574,
0
],
[
3.0598205249059793,
0,
-4.466435624872767
]
] | [
[
6.116675331941745,
3.200338921624323e-17,
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],
[
6.123685606633962,
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-0.5250602367808922
],
[
3.8250453658704218,
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-2.2332178124363833
],
[
3.8250453658704218,
1.327640036177787,
-2.2332178124363... | [
"Er",
"Er",
"Zn",
"Zn",
"Zn",
"Ru"
] | 0 | -24.626822 |
agm001224137 | [
"Er",
"Sc",
"Sn"
] | 4 | 3 | A2BC | Er2ScSn | [
[
0,
0,
4.67684533
],
[
4.68408553,
0,
0
],
[
0,
4.68408553,
0
]
] | [
[
2.342042765,
2.342042765,
2.338422665
],
[
0,
0,
2.338422665
],
[
0,
2.342042765,
0
],
[
2.342042765,
0,
0
]
] | [
"Sc",
"Sn",
"Er",
"Er"
] | 0.078838 | -21.048146 |
agm003414738 | [
"Er",
"Tb",
"Te"
] | 6 | 3 | A3B2C | Er2TbTe3 | [
[
4.36219962,
0,
0
],
[
0,
6.10846483,
0
],
[
-2.18109981,
-3.054232415,
6.48850305
]
] | [
[
0,
3.054232415,
0
],
[
2.18109981,
2.789506816921232e-17,
2.093730473188546
],
[
3.6839005950011486e-17,
3.0542324150000004,
4.394772576811453
],
[
5.112824051348921e-17,
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4.26939069042417
],
[
0,
0,
0
],
[
... | [
"Tb",
"Er",
"Er",
"Te",
"Te",
"Te"
] | 0.041604 | -30.639828 |
agm005573226 | [
"Er",
"Tb",
"Y"
] | 8 | 3 | A3B3C2 | Er3Tb3Y2 | [
[
0,
3.559494376242364,
0
],
[
1.5943534651563451,
0,
-5.953704545925248
],
[
-11.882434099785362,
-1.779747188121182,
0
]
] | [
[
-8.866757868149987,
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-0.24800793332438195
],
[
0.7971767325781726,
1.779747188121182,
-2.976852272962624
],
[
-1.4213227664790293,
1.7797471881211817,
-5.705696612600867
],
[
-4.744646198165612,
1.7797471881211822,
-4.463696569683... | [
"Tb",
"Tb",
"Tb",
"Y",
"Y",
"Er",
"Er",
"Er"
] | 0.009737 | -40.465915 |
agm005747498 | [
"Er",
"Tm",
"Y"
] | 6 | 3 | A4BC | ErTmY4 | [
[
0,
3.58190551741888,
0
],
[
0.7456897188061185,
0,
-6.1658535580565
],
[
-8.60726448210901,
-1.79095275870944,
0
]
] | [
[
-5.662193336094911,
4.7679225157948254e-17,
-0.686841680904638
],
[
-2.19938142720798,
1.79095275870944,
-5.479011877151862
],
[
-5.288524432169796,
1.7909527587094398,
-3.7693683576955057
],
[
-2.5730503311330977,
-4.3014693832192824e-17,
-2.39648520036... | [
"Y",
"Y",
"Y",
"Y",
"Er",
"Tm"
] | 0.013309 | -34.852539 |
agm002213823 | [
"Eu",
"Ga",
"Pt"
] | 8 | 3 | A2BC | EuGa2Pt | [
[
-4.2786948003350185,
0,
0
],
[
2.119417312056911,
0,
-5.391678941670094
],
[
0,
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0
]
] | [
[
-2.154208906818636,
-1.78300224,
-4.684392675088554
],
[
-0.005068581459471221,
-5.34900672,
-0.7072862665815396
],
[
-2.1439513998144224,
-3.1692424057846256,
-1.6143136417383992
],
[
-0.015326088463684788,
-3.9627665542153747,
-3.7773652999316942
],
... | [
"Eu",
"Eu",
"Ga",
"Ga",
"Ga",
"Ga",
"Pt",
"Pt"
] | 0 | -51.070558 |
agm002216382 | [
"Eu",
"H",
"I"
] | 6 | 3 | ABC | EuHI | [
[
4.18506696,
0,
0
],
[
0,
4.18506696,
0
],
[
0,
0,
8.99530047
]
] | [
[
0,
2.09253348,
1.2674486305835644
],
[
2.09253348,
0,
7.727851839416435
],
[
0,
2.09253348,
6.172866900108242
],
[
2.09253348,
0,
2.822433569891758
],
[
2.09253348,
2.09253348,
0
],
[
0,
0,
0
]
] | [
"Eu",
"Eu",
"I",
"I",
"H",
"H"
] | 0 | -37.217333 |
agm001223542 | [
"Eu",
"Hg",
"Sc"
] | 4 | 3 | A2BC | EuHg2Sc | [
[
0,
0,
3.63702853
],
[
5.28409882,
0,
0
],
[
0,
5.28409882,
0
]
] | [
[
2.64204941,
2.64204941,
1.818514265
],
[
0,
0,
1.818514265
],
[
0,
2.64204941,
0
],
[
2.64204941,
0,
0
]
] | [
"Eu",
"Sc",
"Hg",
"Hg"
] | 0.082735 | -18.836249 |
agm001969475 | [
"Eu",
"Rh",
"Sm"
] | 4 | 3 | A2BC | EuRhSm2 | [
[
-2.0157796012858595,
-3.491432686288042,
0
],
[
-4.031559202571719,
0,
0
],
[
-2.0157796012858595,
-1.1638108954293473,
-9.56321137
]
] | [
[
-4.03155920257172,
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-4.781605685000006
],
[
-3.426302994034114e-16,
-4.3361114905117006e-17,
0
],
[
-6.047338803857579,
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-8.00923925107411
],
[
-2.0157796012858595,
-1.1638108954293473,
-1.5539721189258837
]
] | [
"Eu",
"Rh",
"Sm",
"Sm"
] | 0.092692 | -28.464989 |
agm005749239 | [
"F",
"Fe",
"Ho"
] | 14 | 3 | A5BC | F5FeHo | [
[
4.530547508063973,
3.4234847200697627,
0
],
[
4.530547508063973,
-3.4234847200697627,
0
],
[
3.0885805328703824,
0,
-6.921740756439375
]
] | [
[
6.84698290771676,
0.34521228544500776,
-5.191305567329531
],
[
5.30269264128157,
-0.34521228544500776,
-1.7304351891098444
],
[
0,
0,
0
],
[
10.605385282563137,
0,
-3.4608703782196875
],
[
4.885263736226804,
0.18031983578922317,
-6.046397... | [
"Ho",
"Ho",
"Fe",
"Fe",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] | 0.041139 | -86.956541 |
agm003588439 | [
"F",
"Hg",
"K"
] | 12 | 3 | A8B3C | F8HgK3 | [
[
6.04754886,
0,
0
],
[
0,
6.04754886,
0
],
[
-3.02377443,
-3.02377443,
5.8638756
]
] | [
[
3.0237744300000005,
-5.4191405252090873e-17,
2.9319377999999996
],
[
-1.0838281050418175e-16,
-1.0838281050418175e-16,
5.863875599999999
],
[
-2.762360101771222e-16,
3.0237744300000013,
2.9319377999999996
],
[
0,
0,
0
],
[
1.3078930506436497,
... | [
"K",
"K",
"K",
"Hg",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] | 0.090439 | -39.423255 |
agm003440465 | [
"F",
"Hg",
"K"
] | 14 | 3 | A4B2C | F4HgK2 | [
[
0,
-6.46103297,
0
],
[
-6.941050033831946,
0,
0
],
[
2.2082504012279784,
0,
-6.9709061168056214
]
] | [
[
-0.3051329227433565,
-1.6152582424999993,
-6.727506612796302
],
[
-4.427666709860611,
-4.8457747275,
-0.24339950400932056
],
[
-3.8051766651534122,
-4.8457747275,
-3.8031700896140097
],
[
-0.927622967450554,
-1.6152582424999993,
-3.167736027191612
],
... | [
"K",
"K",
"K",
"K",
"Hg",
"Hg",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] | 0.072894 | -50.007298 |
agm003523439 | [
"F",
"In",
"Mn"
] | 11 | 3 | A8B2C | F8In2Mn | [
[
1.2758418574961614,
0,
-5.082531076265681
],
[
4.486057418999926,
3.3965580541412885,
0
],
[
4.486057418999926,
-3.3965580541412885,
0
]
] | [
[
0,
0,
0
],
[
3.424399957259464,
9.08377811508579e-17,
-2.222798105268274
],
[
6.823556738236549,
-1.2433553826670533e-16,
-2.859732970997407
],
[
3.565569012179515,
2.082644405463045,
-1.5167938277010498
],
[
6.682387683316499,
2.082644405463... | [
"Mn",
"In",
"In",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] | 0.053156 | -55.774903 |
agm002148716 | [
"F",
"In",
"Na"
] | 10 | 3 | A6B3C | F6In3Na | [
[
-4.401914020859222,
-4.401914020859222,
0
],
[
-4.401914020859222,
0,
-4.401914020859222
],
[
0,
-4.401914020859222,
-4.401914020859222
]
] | [
[
-4.401914020859222,
-4.401914020859222,
-4.401914020859222
],
[
-4.4019140208592225,
-2.1092367050105407,
-4.401914020859222
],
[
-2.1092367050105403,
-4.4019140208592225,
-4.401914020859222
],
[
-6.694591336707903,
-4.401914020859222,
-4.401914020859222... | [
"Na",
"F",
"F",
"F",
"F",
"F",
"F",
"In",
"In",
"In"
] | 0.025727 | -43.16776 |
agm005820527 | [
"F",
"La",
"Tm"
] | 16 | 3 | A6BC | F6LaTm | [
[
5.45015018,
0,
0
],
[
0,
5.45015018,
0
],
[
0,
0,
7.99047183
]
] | [
[
0,
0,
3.995235915
],
[
0,
0,
0
],
[
2.72507509,
2.72507509,
5.9928538725
],
[
2.72507509,
2.72507509,
1.9976179575
],
[
1.1243267955542058,
1.3719923020277585,
2.5115089325886353
],
[
4.325823384445794,
4.078157877972241,
... | [
"La",
"La",
"Tm",
"Tm",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] | 0.056341 | -107.262785 |
agm2000088652 | [
"F",
"S",
"Tl"
] | 6 | 3 | A3B2C | FS2Tl3 | [
[
-3.723141400000003,
-4.017726745000001,
0
],
[
-3.723141400000003,
4.017726745000001,
0
],
[
-1.1145607804981784e-15,
0,
-18.20215888
]
] | [
[
-2.854981820084156,
-1.947688621358013,
-7.750202669299819
],
[
-2.854981820084156,
1.9476886213580131,
-7.750202669299819
],
[
-7.36814590160366,
-9.993431739269721e-17,
-10.952360588517319
],
[
-4.74376190760081,
1.04718439689808,
-9.834517957997075
... | [
"Tl",
"Tl",
"Tl",
"S",
"S",
"F"
] | 0.072936 | -42.66896 |
agm003535541 | [
"Fe",
"H",
"Pr"
] | 11 | 3 | A8B2C | Fe2H8Pr | [
[
0.009508370188582404,
0,
-3.669747211915967
],
[
2.508222411338678,
4.0516741967352985,
0
],
[
2.508222411338678,
-4.0516741967352985,
0
]
] | [
[
2.5129765964329693,
4.0516741967352985,
-1.8348736059579835
],
[
2.508222411338678,
1.4176192970233734,
0
],
[
2.508222411338678,
-1.4176192970233736,
0
],
[
0.9087264680996622,
-1.217975644050728,
-3.6661835203984747
],
[
0.9087264680996624,
... | [
"Pr",
"Fe",
"Fe",
"H",
"H",
"H",
"H",
"H",
"H",
"H",
"H"
] | 0.085316 | -50.053581 |
agm002272178 | [
"Fe",
"Hf",
"In"
] | 6 | 3 | A4BC | Fe4HfIn | [
[
-3.481954114534677,
-3.481954114534677,
0
],
[
-3.481954114534677,
0,
-3.481954114534677
],
[
0,
-3.481954114534677,
-3.481954114534677
]
] | [
[
-1.7409770572673384,
-1.740977057267338,
-1.740977057267338
],
[
-6.090087795330459,
-4.355774548273571,
-4.355774548273571
],
[
-4.355774548273571,
-6.090087795330459,
-4.355774548273571
],
[
-4.355774548273571,
-4.355774548273571,
-6.090087795330459
... | [
"Hf",
"Fe",
"Fe",
"Fe",
"Fe",
"In"
] | 0.010696 | -47.563486 |
agm002021487 | [
"Fe",
"Hf",
"Si"
] | 8 | 3 | A2BC | FeHf2Si | [
[
3.52773516,
0,
0
],
[
0,
3.83858052,
0
],
[
0,
0,
9.90715334
]
] | [
[
0,
1.91929026,
3.2088531585336177
],
[
1.76386758,
0,
6.698300181466383
],
[
0,
1.91929026,
6.012451336620066
],
[
1.76386758,
0,
3.8947020033799347
],
[
0,
0,
8.875625586887406
],
[
1.76386758,
1.91929026,
1.0315277531125... | [
"Si",
"Si",
"Hf",
"Hf",
"Hf",
"Hf",
"Fe",
"Fe"
] | 0.089406 | -72.153239 |
agm005601590 | [
"Fe",
"Hf",
"V"
] | 6 | 3 | ABC | FeHfV | [
[
2.524873695928142,
2.561500964641034,
3.465844986636274
],
[
2.524873695928142,
-2.561500964641034,
-3.465844986636274
],
[
-2.524873695928142,
2.561500964641034,
-3.465844986636274
]
] | [
[
2.5153860254150424e-16,
1.2807504823205165,
-4.36004664861768
],
[
2.524873695928142,
1.280750482320517,
0.8942016619814063
],
[
1.262436847964071,
1.280750482320517,
-1.732922493318137
],
[
3.787310543892213,
1.280750482320517,
-1.732922493318137
],
... | [
"Hf",
"Hf",
"V",
"V",
"Fe",
"Fe"
] | 0 | -56.616499 |
agm005565137 | [
"Fe",
"Hg",
"Sm"
] | 18 | 3 | A5B2C2 | Fe2Hg2Sm5 | [
[
0,
7.42303894245052,
0
],
[
0,
0,
7.53638662
],
[
8.36838227142728,
-3.71151947122526,
0
]
] | [
[
0,
0,
0
],
[
0,
3.71151947122526,
3.76819331
],
[
2.0786713437522826,
2.356688524105238,
6.170127826153589
],
[
2.0786713437522844,
5.066350418345283,
1.3662587938464126
],
[
2.0786713437522844,
1.3548309471200215,
2.4019345161535877
],... | [
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Fe",
"Fe",
"Fe",
"Fe",
"Hg",
"Hg",
"Hg",
"Hg"
] | 0.061307 | -84.950721 |
agm005691554 | [
"Fe",
"La",
"Sn"
] | 9 | 3 | A6B2C | FeLa6Sn2 | [
[
7.321275671262724,
0,
0
],
[
0,
7.321275671262724,
0
],
[
-3.660637835631362,
-3.660637835631362,
5.18434372991493
]
] | [
[
-3.9480949696919294e-16,
-3.9480949696919294e-16,
2.6037650944062998
],
[
-1.8585079706231766,
-1.8585079706231766,
5.18434372991493
],
[
5.519145806254538,
5.519145806254538,
0
],
[
1.8021298650081845,
5.519145806254538,
1.151155555304524e-15
],
[
... | [
"La",
"La",
"La",
"La",
"La",
"La",
"Fe",
"Sn",
"Sn"
] | 0 | -100.143607 |
agm003178375 | [
"Fe",
"Mn",
"W"
] | 4 | 3 | A2BC | Fe2MnW | [
[
-2.922681092661584,
-2.922681092661584,
0
],
[
-2.922681092661584,
0,
-2.922681092661584
],
[
0,
-2.922681092661584,
-2.922681092661584
]
] | [
[
-2.922681092661584,
-2.922681092661584,
-2.922681092661584
],
[
0,
0,
0
],
[
-1.461340546330792,
-1.4613405463307918,
-1.4613405463307918
],
[
-4.384021638992376,
-4.384021638992376,
-4.384021638992376
]
] | [
"Mn",
"Fe",
"Fe",
"W"
] | 0.086074 | -38.880381 |
agm005651924 | [
"Fe",
"Ni",
"Rh"
] | 12 | 3 | A5B5C2 | Fe5Ni5Rh2 | [
[
0,
-3.6858664179332328,
0
],
[
-5.511712923047133,
-1.8429332089666164,
0
],
[
-1.8959677478014023,
-1.8429332089666164,
-7.0848383159386685
]
] | [
[
-3.6766597119762015,
-5.528799626899849,
-5.3632855893782
],
[
-5.594305472832498,
-3.6858664179332328,
-5.387809261270139
],
[
-1.8133751980160373,
-3.6858664179332323,
-1.6970290546685303
],
[
-3.731020958872335,
-1.8429332089666164,
-1.721552726560469... | [
"Fe",
"Fe",
"Fe",
"Fe",
"Fe",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni",
"Rh",
"Rh"
] | 0.046434 | -86.241215 |
agm002323209 | [
"Fe",
"Ni",
"V"
] | 4 | 3 | A2BC | Fe2NiV | [
[
-2.5257670956692704,
-2.52953049,
0
],
[
-2.5257670956692704,
2.52953049,
0
],
[
2.5257670956692704,
0,
-3.641889280022308
]
] | [
[
0,
0,
0
],
[
-1.2628835478346352,
1.264765245,
-1.820944640011154
],
[
-1.2628835478346352,
-1.2647652450000002,
-1.820944640011154
],
[
-2.52576709566927,
-2.8083429914893543e-16,
0
]
] | [
"Ni",
"Fe",
"Fe",
"V"
] | 0.081557 | -64.328027 |
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