ErTm2H7
Alexandria ALEXAlex-ID: agm006209409 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_355_spg2
ErTm3H8 Er3TmH8 TmH3
2024-02-07 08:10:27
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006209409).
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
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm006209409
data_agm006209409
_cell_length_a 6.20522
_cell_length_b 5.03054
_cell_length_c 6.20220
_cell_angle_alpha 113.92493
_cell_angle_beta 33.61728
_cell_angle_gamma 113.89983
_cell_volume 97.10478
_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
H1 H 0.12367 0.82182 0.14752 1.00000
H2 H 0.79419 0.98089 0.81740 1.00000
H3 H 0.62267 0.55474 0.64689 1.00000
H4 H 0.12370 0.29072 0.14735 1.00000
H5 H 0.45167 0.64190 0.47589 1.00000
H6 H 0.45190 0.12705 0.47549 1.00000
H7 H 0.79468 0.47259 0.81726 1.00000
Tm1 Tm 0.62352 0.05640 0.64718 1.00000
Tm2 Tm 0.28753 0.71964 0.31020 1.00000
Er1 Er 0.95887 0.39163 0.98298 1.00000
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