pos listlengths 1 20 | cell listlengths 3 3 | atomic_numbers listlengths 1 20 | pbc listlengths 3 3 | ids stringlengths 4 18 | space_group stringclasses 179
values | chemical_system stringlengths 1 19 | energy_above_hull float64 0 0.1 | dft_band_gap float64 0 9.72 ⌀ | dft_bulk_modulus float64 0.54 401 ⌀ | dft_mag_density float64 -0.18 0.24 ⌀ | hhi_score float64 0 9.1k | ml_bulk_modulus float64 1.09 399 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
[
-1.607260573265785e-16,
2.6248557124957537,
-0.812315209423934
],
[
0,
0,
2.74767602
],
[
1.6057298149999997,
2.6248557124957537,
1.9353608105760662
],
[
1.605729815,
0,
9.832259391176107e-17
]
] | [
[
3.21145963,
0,
1.9664518782352214e-16
],
[
-3.21452114653157e-16,
5.249711424991507,
-1.624630418847868
],
[
0,
0,
5.49535204
]
] | [
40,
40,
49,
82
] | [
1,
1,
1
] | alex<agm003857267> | Cmmm | In-Pb-Zr | 0.087257 | null | null | -0.000035 | 2,134.853092 | 88.214005 |
[
[
2.3288226514766217,
-1.987609754753638,
2.4391856100600773e-16
],
[
2.8608017892572444,
0.9938048773768191,
1.3420912951330857
],
[
0,
0,
0
],
[
1.1644113257383109,
-0.9938048773768187,
2.9376082449999994
]
] | [
[
0.6324321879576882,
-3.9752195095072764,
1.5955169498669135
],
[
4.025213114995555,
0,
-1.5955169498669135
],
[
-0.6324321879576882,
3.9752195095072764,
4.279699540133086
]
] | [
40,
40,
49,
82
] | [
1,
1,
1
] | alex<agm003858178> | I-4m2 | In-Pb-Zr | 0.070028 | null | null | -0.000019 | 2,134.853092 | 82.640205 |
[
[
-0.8180947661225101,
-1.020097990876448,
-1.7827138872883823
],
[
-3.3404727218229002,
1.0200979908764483,
-1.7940706937250352
],
[
-2.079283743972705,
0,
-4.530976450506709
],
[
-3.7159067849288125,
-2.040736532045505,
-2.612180675546572
]
] | [
[
-4.15856748794541,
0,
1.908383738986581
],
[
-0.8853214060331943,
4.081473064091009,
-1.9292078109336932
],
[
0.8853214060331943,
-4.081473064091009,
-3.5559605090663062
]
] | [
40,
40,
49,
82
] | [
1,
1,
1
] | alex<agm003180428> | I4/mmm | In-Pb-Zr | 0.072832 | null | null | 0.00001 | 2,134.853092 | 89.820564 |
[
[
0,
0,
6.858446577654679
],
[
0,
0,
2.1692100123453204
],
[
1.60392613,
1.60392613,
1.9642430011733015e-16
],
[
1.60392613,
1.60392613,
4.513828295
]
] | [
[
3.20785226,
0,
1.9642430011733015e-16
],
[
-1.9642430011733015e-16,
3.20785226,
1.9642430011733015e-16
],
[
0,
0,
9.02765659
]
] | [
40,
40,
49,
82
] | [
1,
1,
1
] | alex<agm003180427> | P4/mmm | In-Pb-Zr | 0.079966 | null | null | -0.000013 | 2,134.853092 | 84.540962 |
[
[
3.9412947785494126,
-2.054887647141683,
5.070128993326938
],
[
5.529932643869185,
0.03043004146805552,
-0.21406488208505037
],
[
0,
0,
0
],
[
2.5022916629109644,
3.284620857050124,
4.8560641112418885
],
[
1.2839004490355739,
-0.03043004146805... | [
[
1.8092497670828291,
-6.569241714100248,
3.511114628758112
],
[
6.813833092904759,
0,
-3.511114628758112
],
[
-1.8092497670828291,
6.569241714100248,
4.8560641112418885
]
] | [
40,
40,
40,
40,
40,
40,
40,
40,
40,
40,
49,
49,
49,
49,
82,
82
] | [
1,
1,
1
] | alex<agm003478389> | I4/mcm | In-Pb-Zr | 0.07447 | null | null | 0.003116 | 2,260.071045 | 82.872635 |
[
[
3.0418274999999997,
2.4989689021162715,
4.328341105000001
],
[
3.0418275000000006,
-2.4989689021162733,
4.328341105
],
[
1.530177133572735e-16,
-2.4989689021162738,
4.328341104999999
],
[
-1.5301771335727338e-16,
2.4989689021162715,
4.328341105
],
[
... | [
[
6.083655,
0,
3.725164311433396e-16
],
[
-4.590531400718202e-16,
7.496906706348817,
4.328341105000002
],
[
4.590531400718202e-16,
-7.496906706348817,
4.328341104999998
]
] | [
40,
40,
40,
40,
40,
40,
40,
40,
40,
40,
50,
50,
50,
50,
50,
50,
34,
34
] | [
1,
1,
1
] | mp-1190294 | P6_3/mcm | Se-Sn-Zr | 0 | 0 | null | 0 | 2,138.37816 | 113.976646 |
[
[
0.9748256399999999,
1.5530344788895676,
14.059282676166358
],
[
2.9244769199999996,
8.448240471110433,
0.6942214138336419
],
[
0.9748256399999996,
6.553671953889568,
8.070973458833642
],
[
2.92447692,
3.4476029961104326,
6.682530631166359
],
[
2.... | [
[
3.89930256,
0,
2.3876341995055403e-16
],
[
-6.124014677455053e-16,
10.00127495,
6.124014677455053e-16
],
[
0,
0,
14.75350409
]
] | [
40,
40,
40,
40,
50,
50,
50,
50,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm002185481> | Pnma | Se-Sn-Zr | 0 | null | null | 0 | 1,963.211538 | 18.074017 |
[
[
1.9196791599999998,
3.3823253116420187,
-0.14633533902604745
],
[
0,
0,
0
],
[
-1.3825760291001138e-16,
2.2579180055224364,
5.088800693482144
],
[
1.91967916,
1.1730863408232903,
1.5315660314818185
],
[
1.9196791599999996,
5.591564282460747,
... | [
[
3.83935832,
0,
2.3509289386838797e-16
],
[
-4.142153866577472e-16,
6.764650623284037,
-0.2926706780520951
],
[
0,
0,
6.78652056
]
] | [
40,
50,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm003744665> | P2/m | Se-Sn-Zr | 0.066188 | null | null | 0 | 1,953.718518 | 15.221291 |
[
[
2.743938520102663,
3.050083535,
1.310073988128734
],
[
1.3618620184825712,
0,
4.01854164925842
],
[
-1.8676375191348972e-16,
3.050083535,
1.8676375191348972e-16
],
[
2.7678156556661633,
0,
1.3805949914355584
],
[
1.385739154046071,
3.05008353... | [
[
4.129677674148734,
0,
-1.3812480093060222
],
[
-3.7352750382697945e-16,
6.10016707,
3.7352750382697945e-16
],
[
0,
0,
6.78038465
]
] | [
3,
3,
3,
3,
3,
51,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003677492> | Cmmm | Li-Pd-Sb | 0 | null | null | -0 | 7,129.574772 | 78.628639 |
[
[
1.918027903569719,
2.5465015647909217,
8.095448396027018
],
[
-2.0577139183204413e-8,
5.825978328663861,
2.5649961910270194
],
[
1.918027903076104,
4.6052540152383665,
5.828238519105872
],
[
-2.0083524451796978e-8,
3.767225878216416,
0.2977863141058725
... | [
[
3.83605577,
0,
2.348906710040618e-16
],
[
-1.9180278870074203,
8.372479893454782,
5.259471295618115e-16
],
[
0,
0,
11.06090441
]
] | [
40,
40,
50,
50,
34,
34,
34,
34,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm002239640> | Cmc2_1 | Se-Sn-Zr | 0.016434 | null | null | -0.000067 | 1,953.718518 | 11.437793 |
[
[
-2.6623844338664524,
-1.5761029587804596,
-5.48579171959668
],
[
0,
0,
0
],
[
-0.5670925169624695,
-0.3357126726393861,
-6.6612452314037025
],
[
-4.757676350770436,
-2.816493244921533,
-4.310338207789658
]
] | [
[
-1.7293484285931724,
-3.152205917560919,
-0.7011267795966801
],
[
-3.595420439139733,
0,
-0.7011267795966801
],
[
0,
0,
-9.56932988
]
] | [
40,
50,
34,
34
] | [
1,
1,
1
] | alex<agm002784704> | R-3m | Se-Sn-Zr | 0.097297 | null | null | 0.000325 | 1,976.779918 | 50.423157 |
[
[
1.99200142,
0,
2.370254326063907
],
[
-1.2197490814499912e-16,
1.99200142,
6.1041228939360925
],
[
0,
0,
0
],
[
1.9920014199999998,
1.99200142,
2.4394981628999824e-16
],
[
1.99200142,
0,
5.243824880785881
],
[
-1.2197490814499912e... | [
[
3.98400284,
0,
2.4394981628999824e-16
],
[
-2.4394981628999824e-16,
3.98400284,
2.4394981628999824e-16
],
[
0,
0,
8.47437722
]
] | [
40,
40,
50,
50,
34,
34
] | [
1,
1,
1
] | alex<agm002185817> | P4/nmm | Se-Sn-Zr | 0.082135 | null | null | -0.000074 | 1,997.76527 | 76.749229 |
[
[
-1.4701508855548555,
-1.0434880526954968,
-2.55119044394825
],
[
-5.8876999609890674,
-4.178989127928256,
-10.197340196255597
],
[
-1.4589214935538697,
-2.6149654390729187,
-5.112770290055055
],
[
-3.690138172537964,
-2.6191972087175843,
-6.3909602361401... | [
[
-1.4614117290794193,
-4.1808469290696575,
-2.5434744229624324
],
[
-4.428905653341701,
0,
-2.5434744229624324
],
[
0,
0,
-5.12154848
]
] | [
67,
48,
29,
29,
29,
29
] | [
1,
1,
1
] | mp-12007 | F-43m | Cd-Cu-Ho | 0 | 0 | null | 0 | 1,954.176505 | 93.800529 |
[
[
1.8612338949999996,
6.22340642513944,
2.45971508513944
],
[
1.8612338949999998,
2.4597150851394396,
1.3039762548605607
],
[
1.8612338949999998,
5.06766759486056,
6.22340642513944
],
[
1.861233895,
1.3039762548605605,
5.06766759486056
],
[
-2.3045... | [
[
3.72246779,
0,
2.279354131976311e-16
],
[
-4.609192552509612e-16,
7.52738268,
4.609192552509612e-16
],
[
0,
0,
7.52738268
]
] | [
67,
67,
67,
67,
48,
48,
29,
29,
29,
29
] | [
1,
1,
1
] | mp-1205581 | P4/mbm | Cd-Cu-Ho | 0 | 0 | null | null | 2,387.472941 | 69.487549 |
[
[
-4.883961591029624,
1.309595934804861,
-5.05740326488408
],
[
1.6079678773671076,
-1.309595934804861,
-5.748726035363759
],
[
-1.6079678773671082,
1.3095959348048607,
-2.7409258946362414
],
[
4.883961591029625,
-1.309595934804861,
-3.4322486651159205
]... | [
[
-4.002060301185998,
-6.931771775071887,
-2.829883977921349
],
[
-4.002060298524415,
6.931771775071887,
-2.829883976039326
],
[
8.004120599710413,
0,
-2.829883976039326
]
] | [
67,
67,
67,
67,
67,
67,
67,
67,
67,
67,
67,
67,
48,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003694117> | Im-3 | Cd-Cu-Ho | 0.026704 | null | null | -0.000002 | 2,771.479821 | 51.203575 |
[
[
0,
0,
0
],
[
0,
0,
7.289893668103074
],
[
0,
0,
4.011894711896925
],
[
1.78104052,
1.78104052,
9.32168499306691
],
[
1.78104052,
1.78104052,
1.980103386933091
],
[
1.78104052,
1.78104052,
5.65089419
]
] | [
[
3.56208104,
0,
2.1811455719697373e-16
],
[
-2.1811455719697373e-16,
3.56208104,
2.1811455719697373e-16
],
[
0,
0,
11.30178838
]
] | [
67,
67,
67,
48,
48,
29
] | [
1,
1,
1
] | alex<agm003436694> | P4/mmm | Cd-Cu-Ho | 0.021176 | null | null | 0.000054 | 2,453.447734 | 50.96962 |
[
[
2.287393820798663,
-2.9121640151172805,
-1.4661754797436826
],
[
-1.7050888430958115,
-0.24020748871381778,
-5.804778523306192
],
[
-0.8369552659656111,
-1.9503076002594424,
-2.8493176848744852
],
[
0.3218878798934515,
-5.094132452594102,
1.0958301101632... | [
[
5.0043454866886705,
0,
-1.4699705803789134
],
[
0.5494626416333435,
-6.548806957817333,
1.8705822602606585
],
[
-5.0043454866886705,
0,
-7.783373539621087
]
] | [
67,
67,
67,
67,
67,
67,
67,
67,
48,
48,
29
] | [
1,
1,
1
] | alex<agm003528167> | C2/m | Cd-Cu-Ho | 0.069619 | null | null | 0.000084 | 2,785.066629 | 35.859596 |
[
[
5.213598954133289e-16,
5.719063654491088,
1.4066077103080942e-15
],
[
0,
0,
0
],
[
0,
2.8595318272455437,
4.812592502290158e-16
],
[
1.1102230246251565e-16,
8.578595481736633,
1.1473930650041097e-15
]
] | [
[
1.3479962307093891,
3.812709102994059,
2.3347979600000004
],
[
1.3479962307093891,
3.812709102994059,
-2.3347979599999995
],
[
-2.695992461418778,
3.812709102994059,
0
]
] | [
67,
48,
29,
29
] | [
1,
1,
1
] | alex<agm002145722> | Fm-3m | Cd-Cu-Ho | 0.072322 | null | null | 0.000001 | 2,096.900156 | 61.091141 |
[
[
-2.27692624,
-1.314583977588923,
-2.0861327550000004
],
[
-2.27692624,
1.314583977588923,
-6.258398264999999
],
[
0,
0,
-4.17226551
],
[
0,
0,
0
],
[
-2.27692624,
1.314583977588923,
-3.391060529344824
],
[
-2.27692624,
-1.3145... | [
[
-2.2769262400000003,
-3.943751932766767,
-5.576860863421236e-16
],
[
-2.2769262399999994,
3.943751932766767,
2.788430431710618e-16
],
[
0,
0,
-8.34453102
]
] | [
67,
67,
48,
48,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002207575> | P6_3/mmc | Cd-Cu-Ho | 0.041177 | null | null | 0.000211 | 2,096.900156 | 77.959587 |
[
[
1.0482909840294707,
-2.0704894155107976,
-3.7529310995680065
],
[
-0.5913906887282253,
-3.7912082260499185,
-1.9986458283780177
],
[
1.9849741799887723,
0,
-0.5873453063932953
],
[
-1.3577697550083638,
-3.168996055435418,
-4.588677082831254
],
[
... | [
[
3.9699483599775447,
0,
-1.1746906127865904
],
[
0.4569002953012437,
-5.861697641560716,
1.544126222053975
],
[
-3.9699483599775447,
0,
-6.121012537213409
]
] | [
3,
3,
51,
46,
46,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003516219> | C2/m | Li-Pd-Sb | 0.044952 | null | null | 0 | 7,379.081704 | 116.294106 |
[
[
3.2299875674999994,
4.820504485727017,
9.12464737657304
],
[
1.0766625225,
1.3664015942729824,
1.854428363426961
],
[
3.2299875675,
1.7270514457270176,
7.343966233426961
],
[
1.0766625224999997,
4.459854634272983,
3.63510950657304
],
[
3.22998756... | [
[
4.30665009,
0,
2.6370626238830803e-16
],
[
-3.7883873637486494e-16,
6.18690608,
3.7883873637486494e-16
],
[
0,
0,
10.97907574
]
] | [
67,
67,
67,
67,
48,
48,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003628162> | Pnma | Cd-Cu-Ho | 0.086865 | null | null | -0 | 2,096.900156 | 71.674599 |
[
[
-0.8797238759698198,
-0.5384519951862689,
-5.864447886964735
],
[
-4.408097811935806,
-2.6980614334201487,
-2.906120489710536
],
[
-7.02762690635984,
-4.301394826851306,
-2.9751969814704777
],
[
-3.5540986219466384,
-2.1753547293078,
-5.750831078274428
... | [
[
-2.2037095480513997,
-4.313672011901097,
-1.4541906177979573
],
[
-4.843975846185834,
0,
-1.4541906177979573
],
[
0,
0,
-8.7948485
]
] | [
67,
48,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003585338> | R3m | Cd-Cu-Ho | 0.017771 | null | null | 0.000238 | 1,694.394679 | 102.771065 |
[
[
0,
0,
0
],
[
-6.006765739112592,
-3.690020143063965,
-6.2345771270129715
],
[
-1.0045861477874438,
-0.6171279656606589,
-5.2993192933659055
],
[
-4.673581577323117,
-2.871030919065396,
-1.9961866142475642
],
[
-2.3377703095769182,
-1.43611718... | [
[
-2.1827124743684228,
-4.307148108724624,
-1.495558630189438
],
[
-4.828639412531611,
0,
-1.495558630189438
],
[
0,
0,
-8.54277916
]
] | [
67,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003537792> | R-3m | Cd-Cu-Ho | 0.013167 | null | null | -0 | 1,727.650805 | 107.718651 |
[
[
-2.353081151706738e-16,
3.8428731506015366,
5.293066142038619
],
[
2.2109293205507756e-32,
-1.6538140101212578e-16,
4.437367695922765
],
[
3.76569769,
2.662493167615967,
1.5371911470386186
],
[
1.8828488449999998,
1.666909304129433,
6.549359454546181
]... | [
[
3.76569769,
0,
2.305824811307541e-16
],
[
-3.983388019443034e-16,
6.505366318217503,
3.7558749950000014
],
[
3.983388019443034e-16,
-6.505366318217503,
3.7558749949999988
]
] | [
67,
67,
67,
48,
48,
48,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002208356> | P-62m | Cd-Cu-Ho | 0.005666 | null | null | -0.000064 | 2,208.170407 | 66.801796 |
[
[
0.98364242,
0.346599380608481,
2.8103971797419547
],
[
2.9509272600000003,
3.350519044391519,
7.167365414741955
],
[
2.95092726,
7.047637469391519,
5.903539290258046
],
[
0.9836424199999998,
4.043717805608481,
1.5465710552580458
],
[
2.95092726,
... | [
[
3.93456968,
0,
2.409229082317113e-16
],
[
-4.527664245244954e-16,
7.39423685,
4.527664245244954e-16
],
[
0,
0,
8.71393647
]
] | [
67,
67,
67,
67,
48,
48,
48,
48,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002335385> | Pnma | Cd-Cu-Ho | 0.03037 | null | null | 0.000363 | 2,208.170407 | 66.731895 |
[
[
1.6869606850000003,
-1.346829125800477,
2.332776475
],
[
0,
0,
0
],
[
-8.246949889549909e-17,
1.3468291258004768,
2.332776475
]
] | [
[
3.37392137,
0,
2.0659310031726766e-16
],
[
-2.4740849668649724e-16,
4.04048737740143,
2.332776475000001
],
[
2.4740849668649724e-16,
-4.04048737740143,
2.3327764749999993
]
] | [
67,
48,
29
] | [
1,
1,
1
] | alex<agm001262995> | P-6m2 | Cd-Cu-Ho | 0.091237 | null | null | -0.000001 | 2,208.170407 | 63.923489 |
[
[
-2.1032503584026633e-16,
3.434868502276784,
5.99487746499704
],
[
-4.354557243163553e-17,
0.7111531661529457,
3.3596277854703995
],
[
1.8102221949999997,
2.391225999088667,
1.0645043393835545
],
[
1.810222195,
1.754795669341063,
8.290000911083885
],
... | [
[
3.62044439,
0,
2.2168828168522457e-16
],
[
-2.5387060827190184e-16,
4.1460216684297295,
-0.8776139895325606
],
[
0,
0,
10.23211924
]
] | [
67,
67,
48,
48,
48,
29,
29
] | [
1,
1,
1
] | alex<agm003306812> | Cmmm | Cd-Cu-Ho | 0.047934 | null | null | 0.000128 | 2,079.625721 | 58.955429 |
[
[
1.8504759682591898,
-1.2854816913506388,
-4.20811909
],
[
-2.7059386759485045,
-3.895251503866013,
-6.3013417709261415
],
[
-1.85047596825919,
1.285481691350638,
-4.20811909
],
[
2.7059386759485045,
3.8952515038660125,
-2.1148964090738596
],
[
1.... | [
[
-1.9149647557691698,
5.141926765402552,
-1.395884507210588
],
[
5.486939117267589,
0,
-1.395884507210588
],
[
-3.571974361498419,
-5.141926765402552,
-5.624469165578825
]
] | [
67,
67,
67,
67,
48,
48,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003433504> | Fmmm | Cd-Cu-Ho | 0.087686 | null | null | -0 | 2,298.368032 | 74.838013 |
[
[
0,
0,
5.756097923011085
],
[
0,
0,
1.6458707369889145
],
[
1.77083432,
1.77083432,
3.70098433
],
[
1.77083432,
1.77083432,
2.16864658180828e-16
]
] | [
[
3.54166864,
0,
2.16864658180828e-16
],
[
-2.16864658180828e-16,
3.54166864,
2.16864658180828e-16
],
[
0,
0,
7.40196866
]
] | [
67,
67,
48,
29
] | [
1,
1,
1
] | alex<agm001124968> | P4/mmm | Cd-Cu-Ho | 0.017901 | null | null | -0.000001 | 2,498.966394 | 48.936401 |
[
[
0,
3.099783090486736,
5.030378663617441e-16
],
[
4.440892098500626e-16,
9.299349271460208,
7.771561172376096e-16
],
[
4.440892098500626e-16,
6.1995661809734735,
1.6309594841334988e-16
],
[
0,
0,
0
]
] | [
[
1.4612517623270433,
4.133044120648981,
2.5309622950000006
],
[
1.4612517623270433,
4.133044120648981,
-2.5309622949999997
],
[
-2.9225035246540862,
4.133044120648981,
0
]
] | [
67,
67,
48,
29
] | [
1,
1,
1
] | alex<agm001089889> | Fm-3m | Cd-Cu-Ho | 0.067773 | null | null | -0.000031 | 2,498.966394 | 55.896477 |
[
[
5.446109135128132,
4.216681166589377,
5.136237049930989
],
[
0.48615633316809204,
2.7557991434106235,
1.2356418451284847
],
[
3.4522890673162046,
0.7304410115893767,
0.06863360765822048
],
[
2.4799764009800196,
6.2420392984106225,
6.303245287401253
],
... | [
[
5.932265468296224,
0,
-2.334016474940528
],
[
-4.2694128468797224e-16,
6.97248031,
4.2694128468797224e-16
],
[
0,
0,
8.70589537
]
] | [
3,
3,
3,
3,
51,
51,
51,
51,
51,
51,
46,
46,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003335765> | Cmce | Li-Pd-Sb | 0.095094 | null | null | -0.00032 | 5,846.733148 | 77.500351 |
[
[
0,
0,
0
],
[
0,
0,
7.494328036797288
],
[
0,
0,
3.351504103202713
],
[
1.76195682,
1.76195682,
5.42291607
],
[
1.76195682,
1.76195682,
9.140705616234793
],
[
1.76195682,
1.76195682,
1.7051265237652078
]
] | [
[
3.52391364,
0,
2.157774779848849e-16
],
[
-2.157774779848849e-16,
3.52391364,
2.157774779848849e-16
],
[
0,
0,
10.84583214
]
] | [
67,
67,
67,
48,
29,
29
] | [
1,
1,
1
] | alex<agm002334732> | P4/mmm | Cd-Cu-Ho | 0.014878 | null | null | -0.000001 | 2,547.514181 | 53.479263 |
[
[
0.002441279811657502,
0.6416229044563371,
2.00783093
],
[
2.1042243486235903,
4.390805171539533,
6.023492790000001
],
[
2.0835714343830265,
1.42981834640718,
7.6095232563933575
],
[
0.0230941940522222,
3.602609729588689,
0.4218004636066427
],
[
2... | [
[
4.14587773,
0,
2.538617945850397e-16
],
[
-2.0392121015647513,
5.0324280759958695,
3.3248494327759565e-16
],
[
0,
0,
8.03132372
]
] | [
67,
67,
48,
48,
48,
48,
29,
29
] | [
1,
1,
1
] | alex<agm002208340> | Cmcm | Cd-Cu-Ho | 0.022208 | null | null | -0 | 1,982.958137 | 57.619022 |
[
[
-4.64253353169457,
-4.1653928246085155,
-5.243384205640376
],
[
-2.538102292805013,
-2.277246466050504,
-2.866591136830366
],
[
-6.4134889340649,
-5.754336636295425,
-7.2435419906704555
],
[
-0.767146890434683,
-0.6883026543635947,
-0.8664333518002865
... | [
[
-0.7000723933276563,
-6.442639290659019,
-0.790677871235371
],
[
-6.480563431171928,
0,
-0.790677871235371
],
[
0,
0,
-6.5286196
]
] | [
67,
67,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003301208> | R-3m | Cd-Cu-Ho | 0.063579 | null | null | -0.000132 | 1,820.194565 | 101.682121 |
[
[
1.75423746,
1.75423746,
2.0978106742719147
],
[
1.75423746,
1.75423746,
5.4449048263360895
],
[
1.75423746,
1.75423746,
8.81880444
],
[
1.75423746,
1.75423746,
12.19270405366391
],
[
1.75423746,
1.75423746,
15.539798205728085
],
[
... | [
[
3.50847492,
0,
2.148321290333383e-16
],
[
-2.148321290333383e-16,
3.50847492,
2.148321290333383e-16
],
[
0,
0,
17.63760888
]
] | [
67,
67,
67,
67,
67,
48,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm003641008> | P4/mmm | Cd-Cu-Ho | 0.010952 | null | null | 0 | 2,588.742129 | 57.6688 |
[
[
-1.2755882270086517e-33,
1.5626576760498313e-16,
3.1996434131623808
],
[
4.612717,
2.77097247885017,
5.939803233418811
],
[
1.696731288374634e-16,
-2.77097247885017,
5.939803233418809
],
[
2.3063585,
-2.90351879839475e-16,
5.688586700230481
],
[
... | [
[
4.612717,
0,
2.824474554711291e-16
],
[
-3.9981697603183816e-16,
6.529506733046725,
3.7698124700000015
],
[
3.9981697603183816e-16,
-6.529506733046725,
3.769812469999999
]
] | [
68,
68,
68,
12,
12,
12,
49,
49,
49
] | [
1,
1,
1
] | mp-1205779 | P-62m | Er-In-Mg | 0 | 0 | null | 0.000011 | 2,481.51458 | 42.749203 |
[
[
8.726331240848869e-17,
-1.4251180416956921,
2.4683768549999994
],
[
1.7767867249999998,
1.425118041695692,
2.4683768550000003
],
[
1.776786725,
0,
4.93675371
]
] | [
[
3.55357345,
0,
2.1759361755387586e-16
],
[
-2.61789937225466e-16,
4.275354125087076,
2.4683768550000007
],
[
2.61789937225466e-16,
-4.275354125087076,
2.468376854999999
]
] | [
68,
12,
49
] | [
1,
1,
1
] | alex<agm001272946> | P-6m2 | Er-In-Mg | 0.082403 | null | null | -0 | 2,481.51458 | 47.77594 |
[
[
0,
0,
-3.51163993
],
[
0,
0,
0
],
[
-2.47339201,
1.428013542784968,
-1.755819965
],
[
-2.4733920100000004,
-1.4280135427849698,
-5.267459895
],
[
-2.47339201,
1.428013542784968,
-5.267459895
],
[
-2.4733920100000004,
-1.428013... | [
[
-2.4733920100000004,
-4.284040628354909,
-6.058063216166277e-16
],
[
-2.4733920099999995,
4.284040628354909,
3.0290316080831384e-16
],
[
0,
0,
-7.02327986
]
] | [
68,
68,
12,
12,
49,
49
] | [
1,
1,
1
] | alex<agm002285784> | P6_3/mmc | Er-In-Mg | 0.042985 | null | null | -0.000154 | 2,481.51458 | 47.821663 |
[
[
-2.9129515449089323,
-1.8521575449483028,
-4.538347129413885
],
[
-5.368018021497132,
-3.4131755803872124,
-4.242631408269486
],
[
-4.264396653589527,
-2.7114541092873066,
-7.077292813872118
],
[
-1.924164846399303,
-1.2234520152631576,
-1.06790997809195... | [
[
-1.7239389710636177,
-3.680096156286315,
-1.5821918891734936
],
[
-4.06387417318317,
0,
-1.5821918891734936
],
[
0,
0,
-6.01014473
]
] | [
3,
51,
51,
46
] | [
1,
1,
1
] | alex<agm005119814> | R3m | Li-Pd-Sb | 0.088398 | null | null | 0.000103 | 4,787.254575 | 62.047989 |
[
[
3.3306690738754696e-16,
3.228931549234947,
-7.06558778151844e-17
],
[
6.661338147750939e-16,
9.68679464770484,
4.844556344973938e-16
],
[
0,
0,
0
],
[
1.0041152197790877e-15,
6.457863098469893,
-1.413117556303688e-16
]
] | [
[
1.5221329296341437,
4.3052420656465955,
2.6364115700000004
],
[
1.5221329296341437,
4.3052420656465955,
-2.6364115699999995
],
[
-3.044265859268287,
4.3052420656465955,
0
]
] | [
68,
68,
12,
49
] | [
1,
1,
1
] | mp-863702 | Fm-3m | Er-In-Mg | 0 | 0 | null | -0.000022 | 2,699.923149 | 48.375889 |
[
[
-1.5299595890811076e-16,
2.498613625,
1.5299595890811076e-16
],
[
0,
0,
2.498613625
],
[
2.087578805,
0,
1.2782733507555533e-16
],
[
2.087578805,
2.498613625,
2.4986136250000004
]
] | [
[
4.17515761,
0,
2.5565467015111066e-16
],
[
-3.059919178162215e-16,
4.99722725,
3.059919178162215e-16
],
[
0,
0,
4.99722725
]
] | [
68,
68,
12,
49
] | [
1,
1,
1
] | alex<agm001214229> | P4/mmm | Er-In-Mg | 0.031689 | null | null | -0.00007 | 2,699.923149 | 50.296318 |
[
[
0,
0,
5.49562492691158
],
[
0,
0,
1.8495478530884215
],
[
1.8906322199999999,
1.89063222,
3.6725863900000006
],
[
1.8906322199999999,
1.89063222,
2.3153566965878547e-16
]
] | [
[
3.78126444,
0,
2.3153566965878547e-16
],
[
-2.3153566965878547e-16,
3.78126444,
2.3153566965878547e-16
],
[
0,
0,
7.34517278
]
] | [
68,
68,
12,
49
] | [
1,
1,
1
] | alex<agm001151312> | P4/mmm | Er-In-Mg | 0.044373 | null | null | 0.000644 | 2,699.923149 | 45.524162 |
[
[
0,
0,
6.705141642286255
],
[
0,
0,
2.2740836177137456
],
[
2.29062627,
2.329242325,
6.752817108180983
],
[
2.29062627,
2.329242325,
2.226408151819018
],
[
-1.4262495788748945e-16,
2.329242325,
1.4262495788748945e-16
],
[
-1.426249... | [
[
4.58125254,
0,
2.805208129598341e-16
],
[
-2.852499157749789e-16,
4.65848465,
2.852499157749789e-16
],
[
0,
0,
8.97922526
]
] | [
68,
68,
12,
12,
12,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003329788> | Pmmm | Er-In-Mg | 0.039218 | null | null | -0.000021 | 2,343.931069 | 45.910988 |
[
[
0,
0,
3.7885641427215426
],
[
0,
0,
8.268716287278458
],
[
0,
0,
0
],
[
-1.4770248588194478e-16,
2.41216465,
6.028640215
],
[
2.41216465,
0,
6.028640215
],
[
2.41216465,
2.41216465,
3.7974597630771885
],
[
2.412164... | [
[
4.8243293,
0,
2.9540497176388955e-16
],
[
-2.9540497176388955e-16,
4.8243293,
2.9540497176388955e-16
],
[
0,
0,
12.05728043
]
] | [
68,
68,
12,
49,
49,
49,
49,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003534562> | P4/mmm | Er-In-Mg | 0.062782 | null | null | 0.000194 | 2,259.527841 | 43.27356 |
[
[
2.169183413585942,
-1.3442764324853718,
-4.705929015
],
[
-2.4941023970945295,
-4.024593023296393,
-7.583391077090422
],
[
-2.169183413585942,
1.3442764324853722,
-4.705929015
],
[
2.4941023970945286,
4.024593023296393,
-1.8284669529095772
],
[
-... | [
[
-2.672229131652388,
5.377105729941488,
-1.2214725902205428
],
[
6.004504522691382,
0,
-1.2214725902205428
],
[
-3.3322753910389937,
-5.377105729941488,
-6.968912849558913
]
] | [
68,
68,
68,
68,
12,
12,
12,
12,
12,
12,
49,
49
] | [
1,
1,
1
] | alex<agm003413642> | Fmmm | Er-In-Mg | 0.073159 | null | null | 0.000006 | 2,495.159033 | 49.355495 |
[
[
-4.0964046642580785,
0.8047286258288749,
-6.089624963277681
],
[
-0.43091523233690854,
-0.8047286258288747,
-1.5772069331542145
],
[
-0.441427928990262,
3.4029947395593254,
-1.615684795883315
],
[
-3.1624684013574393,
0.8892879406148151,
-2.6712943077720... | [
[
-4.527319896594987,
0,
1.2369278035681055
],
[
-0.882855857980524,
6.805989479118651,
-3.2313695917666294
],
[
0.882855857980524,
-6.805989479118651,
-5.672390108233371
]
] | [
68,
68,
68,
12,
12,
12,
12,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003381714> | Immm | Er-In-Mg | 0.086804 | null | null | -0.000099 | 2,383.763202 | 44.322044 |
[
[
0,
0,
2.395016455
],
[
-1.37502083977517e-16,
2.245579445,
1.37502083977517e-16
],
[
2.245579445,
0,
1.37502083977517e-16
],
[
2.245579445,
2.245579445,
2.3950164550000004
]
] | [
[
4.49115889,
0,
2.75004167955034e-16
],
[
-2.75004167955034e-16,
4.49115889,
2.75004167955034e-16
],
[
0,
0,
4.79003291
]
] | [
68,
12,
12,
49
] | [
1,
1,
1
] | alex<agm001213255> | P4/mmm | Er-In-Mg | 0.064017 | null | null | 0.00005 | 2,335.876221 | 42.862999 |
[
[
-1.3166482732378457,
-3.9899624733923567,
-3.99101915928663
],
[
2.887266047869781,
-6.854437045635802,
0.26445112539644083
],
[
1.7974206309480618,
-5.960151703327047,
-3.0390841633797954
],
[
0.6969752060453701,
-2.0343323110069593,
-6.374750072011777
... | [
[
5.050383080432533,
0,
-1.6661353279434286
],
[
1.3561861920651488,
-7.280225396059584,
4.110866436507496
],
[
-5.050383080432533,
0,
-6.821283342056572
]
] | [
68,
68,
68,
68,
68,
68,
68,
68,
12,
49,
49
] | [
1,
1,
1
] | alex<agm003533281> | C2/m | Er-In-Mg | 0.04145 | null | null | -0.000554 | 2,901.639434 | 50.348492 |
[
[
1.9674834463390847,
1.2862407165284357,
1.3763116465672924
],
[
2.8832497810235087,
1.448447933700995,
6.99024630716504
],
[
4.4195187537595775,
4.022989082458383,
10.104025524274386
],
[
3.5037524190751537,
3.860781865285824,
4.490090863676639
],
[
... | [
[
4.35017461555746,
0,
1.0796508004626584
],
[
2.0368275845412023,
5.309229798986819,
1.0969073103790208
],
[
0,
0,
9.30377906
]
] | [
3,
3,
3,
3,
51,
51,
51,
51,
46,
46
] | [
1,
1,
1
] | alex<agm003392206> | C2/m | Li-Pd-Sb | 0.091552 | null | null | -0.000112 | 4,776.050926 | 50.943855 |
[
[
2.243516405,
2.307120035,
2.3071200350000005
],
[
2.243516405,
0,
1.3737575921089134e-16
],
[
-1.4127035830557397e-16,
2.307120035,
1.4127035830557397e-16
],
[
0,
0,
2.307120035
]
] | [
[
4.48703281,
0,
2.747515184217827e-16
],
[
-2.8254071661114794e-16,
4.61424007,
2.8254071661114794e-16
],
[
0,
0,
4.61424007
]
] | [
68,
12,
49,
49
] | [
1,
1,
1
] | alex<agm001214208> | P4/mmm | Er-In-Mg | 0 | null | null | 0 | 2,350.254986 | 48.240902 |
[
[
2.249754075,
1.2867871719655215,
2.5502440430344784
],
[
2.249754075,
2.5502440430344784,
6.387275258034479
],
[
2.2497540749999994,
6.387275258034479,
5.123818386965522
],
[
2.2497540749999994,
5.123818386965522,
1.286787171965522
],
[
-2.349503... | [
[
4.49950815,
0,
2.7551541268174643e-16
],
[
-4.69900799567823e-16,
7.67406243,
4.69900799567823e-16
],
[
0,
0,
7.67406243
]
] | [
68,
68,
68,
68,
12,
12,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm002220656> | P4/mbm | Er-In-Mg | 0.050858 | null | null | -0.000105 | 2,563.356665 | 48.739891 |
[
[
2.105914455406813,
-1.3546287158122234,
-4.665112430000001
],
[
0.8675912169750144,
1.3487628483618652,
-0.6425971581267972
],
[
-2.105914455406813,
1.3546287158122245,
-4.66511243
],
[
2.617866519433548,
4.0697520148870305,
-1.9389702809678568
],
[
... | [
[
-2.469100042609344,
5.418514863248896,
-1.290783719547327
],
[
5.954557779017907,
0,
-1.290783719547327
],
[
-3.4854577364085633,
-5.418514863248896,
-6.748657420905346
]
] | [
68,
68,
68,
68,
12,
12,
49,
49,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003428175> | Fmmm | Er-In-Mg | 0.037085 | null | null | -0.000033 | 2,471.382258 | 52.071083 |
[
[
1.8966742799999998,
1.89667428,
1.8400654514383707
],
[
1.8966742799999998,
1.89667428,
5.506293384709456
],
[
1.8966742799999998,
1.89667428,
9.188279585
],
[
1.8966742799999998,
1.89667428,
12.870265785290544
],
[
1.8966742799999998,
1.8966... | [
[
3.79334856,
0,
2.322756086027111e-16
],
[
-2.322756086027111e-16,
3.79334856,
2.322756086027111e-16
],
[
0,
0,
18.37655917
]
] | [
68,
68,
68,
68,
68,
12,
12,
12,
12,
49
] | [
1,
1,
1
] | alex<agm003649158> | P4/mmm | Er-In-Mg | 0.04579 | null | null | 0.000262 | 2,738.405163 | 45.846836 |
[
[
0,
0,
0
],
[
0,
0,
7.452156228337575
],
[
0,
0,
3.722668451662426
],
[
1.8849740899999998,
1.88497409,
9.331530755887439
],
[
1.8849740899999998,
1.88497409,
1.8432939241125617
],
[
1.8849740899999998,
1.88497409,
5.587412... | [
[
3.76994818,
0,
2.308427485794195e-16
],
[
-2.308427485794195e-16,
3.76994818,
2.308427485794195e-16
],
[
0,
0,
11.17482468
]
] | [
68,
68,
68,
12,
12,
49
] | [
1,
1,
1
] | alex<agm003411134> | P4/mmm | Er-In-Mg | 0.048168 | null | null | -0.000001 | 2,720.138454 | 46.240597 |
[
[
0,
0,
0
],
[
-2.7527070560918157,
-1.4089409880212955,
-5.678878633778721
],
[
-0.772354149537463,
1.4089409880212955,
-4.657598914137556
],
[
-1.4425804482549496,
-2.052675273520748,
-8.699326866697854
],
[
-2.0824807573743294,
2.05267527352... | [
[
-3.525061205629279,
0,
0.584549172083724
],
[
-0.18119131370558833,
4.758056338088669,
-1.092654820575289
],
[
0.18119131370558833,
-4.758056338088669,
-9.828371899424711
]
] | [
68,
68,
68,
12,
12,
49,
49
] | [
1,
1,
1
] | alex<agm003312255> | Immm | Er-In-Mg | 0.083815 | null | null | 0.000307 | 2,614.135352 | 46.768452 |
[
[
1.7239519249999997,
2.50804912,
4.062710087024879
],
[
-1.535737163456168e-16,
2.50804912,
10.34855822098812
],
[
0,
0,
2.133774264616874
],
[
1.723951925,
0,
8.41543253128147
],
[
-1.535737163456168e-16,
2.50804912,
7.054035321730586
]... | [
[
3.44790385,
0,
2.111232206835168e-16
],
[
-3.071474326912336e-16,
5.01609824,
3.071474326912336e-16
],
[
0,
0,
12.48135869
]
] | [
68,
68,
68,
68,
12,
12,
12,
49
] | [
1,
1,
1
] | alex<agm003554875> | Pmm2 | Er-In-Mg | 0.097187 | null | null | 0 | 2,731.313925 | 47.401684 |
[
[
-1.2672352583510424,
2.1612092137171777,
-7.448809713683351
],
[
2.226089698714051,
1.318224243332127,
-1.8200606761280302
],
[
1.6195734447941577,
0.9655770992546544,
-5.345543670802837
],
[
-1.619573444794157,
-0.9655770992546548,
-9.536141889197161
... | [
[
-2.534470516702086,
4.322418427434357,
-0.01593386736670339
],
[
4.941391313899256,
0,
-0.8305104652600573
],
[
-2.4069207971971704,
-4.322418427434357,
-14.035241227373238
]
] | [
68,
68,
68,
68,
68,
12,
12,
49,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003374637> | R-3m | Er-In-Mg | 0.091255 | null | null | 0.000006 | 2,580.543114 | 48.097233 |
[
[
0,
0,
0
],
[
0,
0,
7.47474564964803
],
[
0,
0,
3.782745580351969
],
[
1.8645490699999998,
1.86454907,
5.628745615
],
[
1.8645490699999998,
1.86454907,
9.310437987601137
],
[
1.8645490699999998,
1.86454907,
1.94705324239886... | [
[
3.72909814,
0,
2.283414050428674e-16
],
[
-2.283414050428674e-16,
3.72909814,
2.283414050428674e-16
],
[
0,
0,
11.25749123
]
] | [
68,
68,
68,
12,
49,
49
] | [
1,
1,
1
] | alex<agm003416682> | P4/mmm | Er-In-Mg | 0.0446 | null | null | 0.000102 | 2,682.129048 | 46.496937 |
[
[
1.6286624436665455e-16,
-2.659807619307842,
4.606921934999999
],
[
3.286382274999999,
2.6598076193078413,
4.606921935000001
],
[
-1.6286624436665448e-16,
2.6598076193078413,
4.606921934999999
],
[
3.286382275,
-2.6598076193078426,
4.606921935
],
[
... | [
[
6.57276455,
0,
4.0246575338533464e-16
],
[
-4.8859873309996355e-16,
7.979422857923526,
4.606921935000002
],
[
4.8859873309996355e-16,
-7.979422857923526,
4.606921934999998
]
] | [
68,
68,
68,
68,
68,
68,
68,
68,
68,
68,
12,
12,
49,
49,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003567956> | P6_3/mcm | Er-In-Mg | 0.004794 | null | null | 0.000641 | 2,733.134781 | 48.618645 |
[
[
-2.2799100500000002,
-1.3163066810956334,
-2.0746547600000005
],
[
-2.27991005,
1.3163066810956332,
-6.223964280000001
],
[
0,
0,
0
],
[
0,
0,
-4.14930952
],
[
-2.2799100500000002,
-1.3163066810956334,
-7.505518524595773
],
[
-2.2... | [
[
-2.2799100500000002,
-3.948920043286899,
-5.584169090152763e-16
],
[
-2.2799100499999994,
3.948920043286899,
2.7920845450763817e-16
],
[
0,
0,
-8.29861904
]
] | [
69,
69,
49,
49,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002207741> | P6_3/mmc | Cu-In-Tm | 0.039185 | null | null | 0.000255 | 2,297.635035 | 85.583138 |
[
[
2.2475226899999994,
4.577520392252373,
1.1106691122523733
],
[
2.2475226899999994,
5.823033447747628,
4.5775203922523735
],
[
2.24752269,
2.3561821677476273,
5.823033447747628
],
[
2.24752269,
1.1106691122523729,
2.356182167747628
],
[
-3.6226505... | [
[
4.49504538,
0,
2.752421468319549e-16
],
[
-4.2456683231719045e-16,
6.93370256,
4.2456683231719045e-16
],
[
0,
0,
6.93370256
]
] | [
3,
3,
3,
3,
51,
51,
51,
51,
46,
46
] | [
1,
1,
1
] | alex<agm002988956> | P4/mbm | Li-Pd-Sb | 0.083734 | null | null | -0.000001 | 4,776.050926 | 53.071533 |
[
[
0,
0,
3.764713789168224
],
[
0,
0,
7.915593374563998
],
[
0,
0,
12.070711855436002
],
[
0,
0,
16.221591440831777
],
[
0,
0,
0
],
[
1.78446242,
1.78446242,
1.7400892774491385
],
[
1.78446242,
1.78446242,
5.8... | [
[
3.56892484,
0,
2.18533619085174e-16
],
[
-2.18533619085174e-16,
3.56892484,
2.18533619085174e-16
],
[
0,
0,
19.98630523
]
] | [
68,
68,
68,
68,
12,
49,
49,
49,
49,
49
] | [
1,
1,
1
] | alex<agm003649160> | P4/mmm | Er-In-Mg | 0.046053 | null | null | 0.00006 | 2,551.889689 | 47.453339 |
[
[
3.0570308330551175,
7.911838458277735,
4.086622525160588
],
[
0.2802691437853668,
5.980166163765546,
1.590179955286549
],
[
3.548571131825117,
0.06701438503094964,
6.203247122193205
],
[
6.325332821094869,
1.998686679543139,
8.699689692067244
],
[
... | [
[
6.577804921121283,
0,
0.029468481665820057
],
[
0.0277970437589524,
7.978852843308685,
2.027843065687973
],
[
0,
0,
8.2325581
]
] | [
63,
63,
63,
63,
63,
63,
13,
13,
13,
13,
15,
15,
15,
15,
15,
15,
15,
15
] | [
1,
1,
1
] | mp-1205409 | C2/c | Al-Eu-P | 0 | 0.0266 | null | 0.09721 | 3,312.177684 | 49.585884 |
[
[
2.288152001015867,
4.923064594030442,
6.870267000000001
],
[
7.18274214323314e-10,
3.48088040127591,
2.2900890000000005
],
[
0,
0,
0
],
[
0,
0,
4.580178
],
[
6.424818512862589e-10,
3.1135775813110502,
8.170057393908001
],
[
2.2881... | [
[
4.576304,
0,
2.802178022762615e-16
],
[
-2.2881519982658594,
8.403944995306352,
5.333260569900243e-16
],
[
0,
0,
9.160356
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
30,
30,
30,
30,
30,
30,
50,
50
] | [
1,
1,
1
] | mp-1205365 | Cmcm | La-Sn-Zn | 0 | 0 | null | 0.000062 | 2,311.517612 | 56.058918 |
[
[
0,
0,
-12.884550749999999
],
[
0,
0,
-4.29485025
],
[
0,
0,
-8.5897005
],
[
0,
0,
0
],
[
-2.313981915,
-1.3359780815251758,
-14.518208708693999
],
[
-2.313981915,
-1.3359780815251758,
-11.250892791305999
],
[
-2.31... | [
[
-2.3139819150000003,
-4.0079342445755275,
-5.667621090979225e-16
],
[
-2.3139819149999994,
4.0079342445755275,
2.8338105454896127e-16
],
[
0,
0,
-17.179401
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
50,
50,
50,
50
] | [
1,
1,
1
] | mp-20190 | P6_3/mmc | La-Sn-Zn | 0 | 0 | null | -0.000001 | 2,305.769767 | 52.840748 |
[
[
3.003161423395846,
-1.3129991135722294,
2.274181175
],
[
0.641963029203525,
-3.9389973407166883,
2.274181174999999
],
[
0.8113098019649718,
1.3129991135722292,
2.2741811749999994
]
] | [
[
4.45643421,
0,
2.728778945443632e-16
],
[
-2.411940242579314e-16,
3.9389973407166883,
2.2741811750000007
],
[
2.411940242579314e-16,
-3.9389973407166883,
2.274181174999999
]
] | [
57,
30,
50
] | [
1,
1,
1
] | alex<agm001263834> | P3m1 | La-Sn-Zn | 0.047708 | null | null | 0.000045 | 2,305.769767 | 54.089344 |
[
[
0,
0,
-4.44140436
],
[
0,
0,
0
],
[
-2.2734865,
1.3125980427739807,
-2.22070218
],
[
-2.2734865000000006,
-1.3125980427739807,
-6.66210654
],
[
-2.2734865,
1.3125980427739807,
-6.66210654
],
[
-2.2734865000000006,
-1.312598042... | [
[
-2.2734865000000006,
-3.937794128321941,
-5.568435930259439e-16
],
[
-2.2734864999999997,
3.937794128321941,
2.7842179651297193e-16
],
[
0,
0,
-8.88280872
]
] | [
57,
57,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm002193898> | P6_3/mmc | La-Sn-Zn | 0.045374 | null | null | 0.000001 | 2,305.769767 | 55.606544 |
[
[
3.4572339599999995,
3.7835950201678097,
7.053120752629332
],
[
1.1524113199999997,
3.7977398198321906,
1.7548908873706697
],
[
1.15241132,
0.007072399832190801,
2.6491149326293306
],
[
3.4572339599999995,
7.57426244016781,
6.15889670737067
],
[
1... | [
[
4.60964528,
0,
2.822593668678352e-16
],
[
-4.642228722535155e-16,
7.58133484,
4.642228722535155e-16
],
[
0,
0,
8.80801164
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
50,
50,
50,
50
] | [
1,
1,
1
] | alex<agm002193899> | Pnma | La-Sn-Zn | 0.075434 | null | null | 0.000195 | 2,305.769767 | 54.251541 |
[
[
-1.1102230246251565e-16,
3.3510551285972787,
5.258155083565085e-16
],
[
4.440892098500626e-16,
10.053165385791837,
6.661338147750939e-16
],
[
2.220446049250313e-16,
6.702110257194558,
4.440892098500626e-16
],
[
0,
0,
0
]
] | [
[
1.5797025370407296,
4.468073504796372,
2.7361250550000005
],
[
1.5797025370407296,
4.468073504796372,
-2.7361250549999996
],
[
-3.1594050740814588,
4.468073504796372,
0
]
] | [
57,
57,
30,
50
] | [
1,
1,
1
] | alex<agm002193900> | Fm-3m | La-Sn-Zn | 0.048269 | null | null | -0.000009 | 2,544.600192 | 49.912483 |
[
[
-1.6154593554982104e-16,
2.63824534,
1.6154593554982104e-16
],
[
0,
0,
2.63824534
],
[
2.090200135,
2.63824534,
2.6382453400000005
],
[
2.090200135,
0,
1.2798784524525577e-16
]
] | [
[
4.18040027,
0,
2.5597569049051155e-16
],
[
-3.2309187109964207e-16,
5.27649068,
3.2309187109964207e-16
],
[
0,
0,
5.27649068
]
] | [
57,
57,
30,
50
] | [
1,
1,
1
] | alex<agm001233117> | P4/mmm | La-Sn-Zn | 0.059906 | null | null | 0.000177 | 2,544.600192 | 45.436127 |
[
[
-2.235529565,
-1.2906835961341176,
-4.733130034021124
],
[
0,
0,
0
],
[
-2.2355295649999998,
1.290683596134118,
-3.6362289559788783
],
[
-2.235529565,
-1.2906835961341176,
-1.8886151543859375
],
[
-2.2355295649999998,
1.290683596134118,
-... | [
[
-2.2355295650000007,
-3.8720507884023516,
-5.475468252353051e-16
],
[
-2.2355295649999998,
3.8720507884023516,
2.7377341261765253e-16
],
[
0,
0,
-8.36935899
]
] | [
3,
3,
3,
51,
51,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003333032> | P-3m1 | Li-Pd-Sb | 0.014489 | null | null | 0 | 6,261.913878 | 86.634949 |
[
[
0,
0,
5.866589238895176
],
[
0,
0,
1.793480361104824
],
[
1.9368964649999998,
1.936896465,
2.3720140561420733e-16
],
[
1.9368964649999998,
1.936896465,
3.8300348000000004
]
] | [
[
3.87379293,
0,
2.3720140561420733e-16
],
[
-2.3720140561420733e-16,
3.87379293,
2.3720140561420733e-16
],
[
0,
0,
7.6600696
]
] | [
57,
57,
30,
50
] | [
1,
1,
1
] | alex<agm001127388> | P4/mmm | La-Sn-Zn | 0.077889 | null | null | -0.000079 | 2,544.600192 | 45.796875 |
[
[
-1.3859074660841044e-16,
2.263358655,
2.47719013563209
],
[
2.263358655,
0,
7.67047194436791
],
[
2.263358655,
2.263358655,
2.7718149321682087e-16
],
[
0,
0,
0
],
[
2.263358655,
0,
1.7205740579201794
],
[
-1.3859074660841044e-16,
... | [
[
4.52671731,
0,
2.7718149321682087e-16
],
[
-2.7718149321682087e-16,
4.52671731,
2.7718149321682087e-16
],
[
0,
0,
10.14766208
]
] | [
57,
57,
30,
30,
50,
50,
50,
50
] | [
1,
1,
1
] | alex<agm003631697> | P4/nmm | La-Sn-Zn | 0.04341 | null | null | 0.000003 | 2,116.10395 | 49.533344 |
[
[
2.34046874,
2.34046874,
2.3430547800000006
],
[
0,
0,
2.34305478
],
[
-1.4331237754727194e-16,
2.34046874,
1.4331237754727194e-16
],
[
2.34046874,
0,
1.4331237754727194e-16
]
] | [
[
4.68093748,
0,
2.866247550945439e-16
],
[
-2.866247550945439e-16,
4.68093748,
2.866247550945439e-16
],
[
0,
0,
4.68610956
]
] | [
57,
30,
50,
50
] | [
1,
1,
1
] | alex<agm001233090> | P4/mmm | La-Sn-Zn | 0.063071 | null | null | 0.00003 | 2,116.10395 | 54.900265 |
[
[
4.163011712986465,
5.332648340195493,
-2.7068332415863106
],
[
4.124938710499245,
-5.332648340195493,
-0.8827033761359957
],
[
2.6602669473988128,
2.122316314532713,
-0.4183578008183017
],
[
5.627683476086897,
-2.122316314532712,
-3.1711788169040043
],... | [
[
3.489641888433926,
7.454964654728205,
3.717633232549302
],
[
4.798308535051785,
-7.454964654728205,
1.7247123097283925
],
[
0,
0,
-9.03188216
]
] | [
57,
57,
57,
57,
57,
57,
57,
57,
57,
57,
57,
57,
30,
30,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003502371> | Immm | La-Sn-Zn | 0.06553 | null | null | -0.000478 | 2,790.619832 | 36.72369 |
[
[
1.9671056149999997,
2.728562214639966,
0.9020889647168542
],
[
1.967105615,
1.6713356581977512,
5.121885974079647
],
[
-5.5272983037323683e-17,
0.9026763157476406,
2.7662935752894686
],
[
-2.1414305928997424e-16,
3.4972215570900764,
3.257681363507033
]... | [
[
3.93421123,
0,
2.4090095949945356e-16
],
[
-2.694160423272979e-16,
4.399897872837717,
-1.435741901203498
],
[
0,
0,
7.45971684
]
] | [
57,
57,
30,
30,
50
] | [
1,
1,
1
] | alex<agm002359996> | Cmmm | La-Sn-Zn | 0.03431 | null | null | 0.000471 | 2,464.646578 | 49.590183 |
[
[
4.081920070886795,
3.6935421152059753,
7.763162220365546
],
[
1.2256185104155133,
1.4705305139188711,
2.935814499735125
],
[
2.904049991674175,
3.6616150296135057,
4.704249329176812
],
[
2.4034885896281337,
1.5024575995113405,
5.994727390923858
],
[
... | [
[
4.11034221226311,
0,
1.5943538457942017
],
[
1.1971963690391985,
5.164072629124846,
3.0090885243064687
],
[
0,
0,
6.09553435
]
] | [
57,
57,
30,
30,
50
] | [
1,
1,
1
] | alex<agm002246208> | Immm | La-Sn-Zn | 0.080714 | null | null | 0.003518 | 2,464.646578 | 47.157082 |
[
[
2.3748426449999998,
4.995308091595314,
1.2978208365953143
],
[
2.3748426449999998,
6.097153673404686,
4.995308091595314
],
[
2.374842645,
2.3996664184046863,
6.097153673404686
],
[
2.374842645,
1.2978208365953139,
2.3996664184046863
],
[
-3.97765... | [
[
4.74968529,
0,
2.908343443677884e-16
],
[
-4.528115931723883e-16,
7.39497451,
4.528115931723883e-16
],
[
0,
0,
7.39497451
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003029385> | P4/mbm | La-Sn-Zn | 0.052906 | null | null | -0.000005 | 2,464.646578 | 48.292744 |
[
[
0.7378756364601327,
1.735118363418893,
7.1084882253003
],
[
4.3440574720666065,
1.5288402396127032,
2.0401776256249957
],
[
6.047071975610995,
3.9329873379369786,
5.051369185026688
],
[
2.4408901400045213,
4.139265461743169,
10.119679784701992
],
[
... | [
[
4.571004078301889,
0,
1.0767230071306313
],
[
2.2139435337692395,
5.668105701355872,
0.8421482931963573
],
[
0,
0,
10.24098611
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003403102> | C2/m | La-Sn-Zn | 0.075159 | null | null | 0.003183 | 2,464.646578 | 48.134148 |
[
[
0.16297990243578936,
-5.061019078817769,
-8.32652444057513
],
[
1.8974408228995907,
-0.1746086676658485,
-2.648845612198458
],
[
-1.7903239596792235,
-6.730284810691306,
-5.860543854344578
],
[
-0.05586303921542248,
-1.8438743995393854,
-0.18286502596790... | [
[
4.951201394045297,
0,
-1.512531014948008
],
[
0.10711686322036648,
-6.904893478357154,
0.35064217345696425
],
[
-4.951201394045297,
0,
-7.3475006250519925
]
] | [
57,
57,
57,
57,
57,
57,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003714137> | C2/m | La-Sn-Zn | 0.079646 | null | null | 0.000031 | 2,673.001531 | 39.413963 |
[
[
-2.9570032400426784,
4.482593543945769,
1.3873819751200713
],
[
2.034816552056635,
1.5423381689601858,
0.1084132668606221
],
[
0.05010122007858048,
4.473068938743989,
3.287290399362061
],
[
-0.9967174093431258,
1.5516453710820979,
5.154659876885333
],
... | [
[
6.177761448556005,
0,
-3.0747886997176415
],
[
-3.813300335381926,
5.704620306163629,
-0.7402706685543181
],
[
0,
0,
6.90292934
]
] | [
57,
57,
57,
57,
57,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003469873> | Cm | La-Sn-Zn | 0.090983 | null | null | 0.000034 | 2,664.227169 | 41.185848 |
[
[
0.6638632059571142,
2.9140544249080644,
3.5351253431608267
],
[
0,
0,
0
],
[
3.6904427489517664,
1.5985795604325361,
8.819703124198238
],
[
3.1564085002317293,
3.348655148082954,
5.818483044093031
],
[
1.1978974546771515,
1.163978837257647,
... | [
[
4.474259227829183,
0,
-0.7106574964828575
],
[
-0.11995327292030221,
4.5126339853406,
-0.7462024161580776
],
[
0,
0,
13.81168838
]
] | [
57,
57,
57,
30,
30,
30,
30,
50,
50,
50,
50
] | [
1,
1,
1
] | alex<agm002324540> | P-1 | La-Sn-Zn | 0.038725 | null | null | 0.000219 | 2,210.102364 | 51.387718 |
[
[
4.36050408,
-2.3321860261534884,
4.03946469
],
[
4.36050408,
2.3321860261534884,
4.039464690000001
],
[
2.1802520400000005,
-5.043220303149698,
2.9117045996060633
],
[
2.1802520399999996,
5.043220303149698,
2.9117045996060655
],
[
4.36050408,
... | [
[
4.36050408,
0,
2.670038682120487e-16
],
[
-4.2841562279175825e-16,
6.996558078460465,
4.039464690000002
],
[
4.2841562279175825e-16,
-6.996558078460465,
4.039464689999998
]
] | [
57,
57,
30,
30,
30,
30,
30,
30,
50,
50,
50
] | [
1,
1,
1
] | alex<agm002193336> | P-62m | La-Sn-Zn | 0.061737 | null | null | -0 | 2,120.708539 | 52.811863 |
[
[
2.377328705,
1.0727546000443544e-16,
3.671053998307212
],
[
2.377328705,
-3.179226021198481,
6.537129220846393
],
[
2.377328705,
3.1792260211984815,
6.537129220846395
],
[
1.1654875714112553e-32,
-3.8552845238172496e-16,
6.498512060426169
],
[
4.... | [
[
4.75465741,
0,
2.911387989099372e-16
],
[
-4.4399159346440386e-16,
7.250932983673792,
4.186328110000002
],
[
4.4399159346440386e-16,
-7.250932983673792,
4.186328109999998
]
] | [
57,
57,
57,
57,
57,
57,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003501200> | P-62m | La-Sn-Zn | 0.022322 | null | null | 0.000893 | 2,717.499425 | 34.255173 |
[
[
0,
0,
0
],
[
2.9787537934558785,
-1.688640269022079,
1.0116631313983113
],
[
1.4296419498639428,
1.6886402690220792,
3.5197709080930784
],
[
1.2839209040591837,
-1.0869971647740253,
3.161006465
],
[
3.124474839260638,
1.0869971647740257,
... | [
[
0.7272878729169124,
-4.347988659096102,
1.79057889050861
],
[
4.408395743319822,
0,
-1.79057889050861
],
[
-0.7272878729169124,
4.347988659096102,
4.53143403949139
]
] | [
57,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm002951255> | I4/mmm | La-Sn-Zn | 0.0662 | null | null | -0.000006 | 2,088.231871 | 46.060841 |
[
[
2.330944981133328,
1.441052711359181,
5.865128332897061
],
[
0,
0,
0
],
[
2.168535122288818e-8,
4.2001468141678435,
1.4131710527795522
],
[
2.330945004168064,
2.1515022769443153,
2.4742010790295397
],
[
-1.3493845686992449e-9,
3.4896972485827... | [
[
4.66189001,
0,
2.854584339361761e-16
],
[
-2.3309450071813202,
5.641199525527024,
-2.0754132243233876
],
[
0,
0,
9.35371261
]
] | [
57,
57,
57,
30,
30,
50,
50,
50,
50
] | [
1,
1,
1
] | alex<agm003338666> | C2/m | La-Sn-Zn | 0.058351 | null | null | 0.000162 | 2,249.781536 | 48.338741 |
[
[
1.8688282999999999,
1.8688283,
2.15116230938604
],
[
1.8688282999999999,
1.8688283,
5.991238912745508
],
[
1.8688282999999999,
1.8688283,
9.8061631
],
[
1.8688282999999999,
1.8688283,
13.621087287254491
],
[
1.8688282999999999,
1.8688283,
... | [
[
3.7376566,
0,
2.2886545957509895e-16
],
[
-2.2886545957509895e-16,
3.7376566,
2.2886545957509895e-16
],
[
0,
0,
19.6123262
]
] | [
57,
57,
57,
57,
57,
30,
30,
30,
30,
50
] | [
1,
1,
1
] | alex<agm003642337> | P4/mmm | La-Sn-Zn | 0.027665 | null | null | 0.000227 | 2,642.245419 | 43.917885 |
[
[
1.8471570456768385,
-1.4146098646799568,
-4.494780015
],
[
1.0442086923703984,
1.3634978034776808,
-0.8460088822050084
],
[
-1.8471570456768411,
1.4146098646799565,
-4.494780015
],
[
3.2891988517977584,
4.294941655242145,
-2.664880559117537
],
[
... | [
[
-1.5276103192696007,
5.658439458719826,
-1.7554447206612727
],
[
5.861017863437757,
0,
-1.7554447206612727
],
[
-4.333407544168157,
-5.658439458719826,
-5.4786705886774545
]
] | [
57,
57,
57,
57,
30,
30,
30,
30,
30,
30,
50,
50
] | [
1,
1,
1
] | alex<agm003427955> | Fmmm | La-Sn-Zn | 0.0226 | null | null | 0.003526 | 2,402.338529 | 51.970161 |
[
[
4.90660575,
-6.052715431058713,
5.897738346550049
],
[
4.906605749999999,
-1.6504870851892906e-16,
6.9890737668998995
],
[
4.906605749999999,
6.052715431058712,
5.897738346550051
],
[
1.6355352499999998,
-2.081233517456618,
8.19067449844995
],
[
... | [
[
6.542141,
0,
4.005906017610332e-16
],
[
-4.980607272113639e-16,
8.13394894851533,
4.696137615000001
],
[
4.980607272113639e-16,
-8.13394894851533,
4.696137614999998
]
] | [
70,
70,
70,
70,
70,
70,
70,
70,
70,
70,
29,
29,
50,
50,
50,
50,
50,
50
] | [
1,
1,
1
] | mp-1190022 | P6_3/mcm | Cu-Sn-Yb | 0.066618 | 0 | null | -0.000048 | 2,605.112867 | 43.840115 |
[
[
4.488940176421757,
2.966176208164696,
6.172887420077178
],
[
1.1395616470292673,
0.7546720885333954,
2.8355859560169674
],
[
0,
0,
0
],
[
2.2375920245772085,
1.4802081488964625,
5.761737902313095
],
[
3.390909798873816,
2.2406401478016296,
... | [
[
4.031907451666973,
0,
1.848932817810672
],
[
1.5965943717840518,
3.7208482966980916,
1.8389496582834726
],
[
0,
0,
5.3205909
]
] | [
3,
3,
51,
46,
46
] | [
1,
1,
1
] | alex<agm003398219> | R-3m | Li-Pd-Sb | 0.035219 | null | null | 0 | 6,241.379469 | 79.304344 |
[
[
-0.8820981443998205,
2.340456007563041,
-3.1635039445774
],
[
-3.4836945249956135,
-2.3404560075630414,
-4.056435066471129
],
[
0,
0,
0
],
[
-3.457756214867385,
4.090843737262673,
-3.9634114667996285
],
[
-0.9080364545280492,
-4.0908437372626... | [
[
-4.365792669395433,
0,
1.2173392789514734
],
[
-0.826552458102128,
6.367963975129079,
-2.9642982238782225
],
[
0.826552458102128,
-6.367963975129079,
-5.472980066121778
]
] | [
70,
70,
70,
29,
29,
29,
29,
50,
50,
50,
50
] | [
1,
1,
1
] | mp-1207635 | Immm | Cu-Sn-Yb | 0.046323 | 0 | null | -0 | 2,203.505365 | 55.707233 |
[
[
3.4305989849999996,
3.57380286998741,
6.246284639277263
],
[
1.143532995,
0.0719009350125905,
2.315103779277263
],
[
3.430598984999999,
7.219506674987409,
5.547257940722737
],
[
1.1435329949999997,
3.717604740012591,
1.6160770807227376
],
[
1.143... | [
[
4.57413198,
0,
2.8008480440922723e-16
],
[
-4.464699495432577e-16,
7.29140761,
4.464699495432577e-16
],
[
0,
0,
7.86236172
]
] | [
70,
70,
70,
70,
29,
29,
29,
29,
50,
50,
50,
50
] | [
1,
1,
1
] | mp-1207590 | Pnma | Cu-Sn-Yb | 0 | 0 | null | 0 | 2,312.66043 | 53.663849 |
[
[
5.884729782501961e-33,
2.0499718522570365e-16,
4.509741416529499
],
[
3.7930017,
2.62823992247394,
1.5174150267352513
],
[
-2.391460039711686e-16,
3.9055506312133663,
5.289700761735252
],
[
1.89650085,
2.1779301845624355,
3.7722857350000005
],
[
... | [
[
3.7930017,
0,
2.3225436955327347e-16
],
[
-4.000792843936186e-16,
6.533790553687306,
3.7722857350000014
],
[
4.000792843936186e-16,
-6.533790553687306,
3.7722857349999988
]
] | [
70,
70,
70,
29,
29,
29,
50,
50,
50
] | [
1,
1,
1
] | alex<agm002268829> | P-62m | Cu-Sn-Yb | 0.051256 | null | null | 0 | 2,312.66043 | 60.483223 |
[
[
0,
0,
0
],
[
8.110103126230816e-16,
2.8133647692559443,
-3.298502748716452e-17
],
[
9.606166686241191e-16,
5.626729538511889,
8.881784197001252e-16
]
] | [
[
1.3262328708614701,
3.7511530256745926,
2.2971027150000003
],
[
1.3262328708614701,
3.7511530256745926,
-2.2971027149999994
],
[
-2.65246574172294,
3.7511530256745926,
0
]
] | [
70,
29,
50
] | [
1,
1,
1
] | alex<agm002334676> | F-43m | Cu-Sn-Yb | 0.090693 | null | null | -0.000022 | 2,312.66043 | 61.243118 |
[
[
0,
0,
0
],
[
2.4191154022494348,
5.37123611271715,
7.8313563791056575
],
[
3.408246402170395,
2.44636051166923,
4.194053281903889
],
[
2.604484918307287,
2.390292708679131,
7.149702365910952
],
[
3.2228768861125427,
5.42730391570725,
4.87... | [
[
4.235553730457309,
0,
1.1518197377563795
],
[
1.5918080739625204,
7.817596624386381,
2.510039843253168
],
[
0,
0,
8.36355008
]
] | [
70,
70,
70,
29,
29,
29,
29,
29,
29,
50,
50,
50,
50,
50
] | [
1,
1,
1
] | mp-17388 | Immm | Cu-Sn-Yb | 0.024741 | 0 | null | 0.000003 | 2,095.702254 | 64.322861 |
[
[
-3.312450776222615e-16,
3.1645755234689914,
5.089112570244581e-16
],
[
0,
9.493726570406974,
3.3306690738754696e-16
],
[
0,
0,
0
],
[
0,
6.329151046937982,
-2.220446049250313e-16
]
] | [
[
1.4917952081479282,
4.219434031291988,
2.5838650950000006
],
[
1.4917952081479282,
4.219434031291988,
-2.5838650949999997
],
[
-2.983590416295856,
4.219434031291988,
0
]
] | [
70,
70,
29,
50
] | [
1,
1,
1
] | alex<agm002146964> | Fm-3m | Cu-Sn-Yb | 0.094753 | null | null | 0 | 2,570.528982 | 44.762924 |
[
[
1.209376247490123,
1.4063764777955827,
2.7725519277268313
],
[
4.155363581580514,
3.3194509768702343,
7.11369993944393
],
[
2.9578521443542356,
3.366181281973657,
4.314054377634093
],
[
2.406887684716401,
1.3596461726921598,
5.572197489536667
],
[
... | [
[
4.067098458203244,
0,
1.7810586753753528
],
[
1.2976413708673928,
4.725827454665817,
2.5709959917954075
],
[
0,
0,
5.5341972
]
] | [
70,
70,
29,
29,
50
] | [
1,
1,
1
] | alex<agm002207872> | Immm | Cu-Sn-Yb | 0 | null | null | 0.000003 | 2,455.594189 | 52.376884 |
[
[
1.7938428599999998,
2.5282661112462996,
1.1785086531853488
],
[
1.79384286,
1.472767957385291,
4.949887312320151
],
[
-4.929151504845638e-17,
0.8049915303379727,
2.7055296738617365
],
[
-1.9570116322300304e-16,
3.196042538293618,
3.4228662916437624
],
... | [
[
3.58768572,
0,
2.1968239166723338e-16
],
[
-2.4499267827145945e-16,
4.001034068631591,
-1.1904503044945007
],
[
0,
0,
7.31884627
]
] | [
70,
70,
29,
29,
50
] | [
1,
1,
1
] | alex<agm002334894> | Cmmm | Cu-Sn-Yb | 0.015806 | null | null | -0.000146 | 2,455.594189 | 54.886158 |
[
[
1.9970535199999997,
4.816069320773902,
1.2759836607739028
],
[
1.9970535199999997,
2.2641019992260976,
5.804187659226098
],
[
1.9970535199999995,
5.8041876592260975,
4.816069320773902
],
[
1.99705352,
1.2759836607739024,
2.2641019992260976
],
[
-... | [
[
3.99410704,
0,
2.4456852009939546e-16
],
[
-4.335354572226445e-16,
7.08017132,
4.335354572226445e-16
],
[
0,
0,
7.08017132
]
] | [
70,
70,
70,
70,
29,
29,
29,
29,
50,
50
] | [
1,
1,
1
] | alex<agm002266885> | P4/mbm | Cu-Sn-Yb | 0.058234 | null | null | 0 | 2,455.594189 | 63.786636 |
[
[
3.6083322882180546,
1.4250898433113133,
4.935098542416183
],
[
0.8495496084587122,
3.3087197243514157,
6.085177483740177
],
[
-0.849549607613252,
3.3087197243514157,
1.9926594187401756
],
[
1.9092330721460908,
1.4250898433113133,
0.8425804774161831
],
... | [
[
5.51756536,
0,
3.3785343786051568e-16
],
[
-2.7587826793951975,
4.733809567662729,
-1.2572781688436416
],
[
0,
0,
8.18503613
]
] | [
70,
70,
70,
70,
29,
29,
29,
29,
50,
50
] | [
1,
1,
1
] | alex<agm002266886> | C2/c | Cu-Sn-Yb | 0.002348 | null | null | -0.000139 | 2,455.594189 | 50.198513 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.