ErTm2URu4
Alexandria ALEXAlex-ID: agm030453489 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_40_spg121
Tm5URu6 Er2URu3 Tm2URu3
2025-03-07 08:27:17
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm030453489).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm030453489
data_agm030453489
_cell_length_a 5.88553
_cell_length_b 5.88553
_cell_length_c 4.72506
_cell_angle_alpha 88.00178
_cell_angle_beta 91.99822
_cell_angle_gamma 70.81158
_cell_volume 154.30014
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Er1 Er 0.93726 0.06274 0.99989 1.00000
Tm1 Tm 0.17778 0.30261 0.50004 1.00000
Tm2 Tm 0.69739 0.82222 0.50004 1.00000
U1 U 0.43732 0.56268 0.00006 1.00000
Ru1 Ru 0.93772 0.56259 0.00015 1.00000
Ru2 Ru 0.43741 0.06228 0.00015 1.00000
Ru3 Ru 0.22095 0.77905 0.56195 1.00000
Ru4 Ru 0.65391 0.34609 0.43784 1.00000
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