Eu2ScH9
Alexandria ALEXAlex-ID: agm101968024 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C9_625_spg1
ScH3 H2 EuH2
2025-05-23 15:22:37
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm101968024).
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 agm101968024
data_agm101968024
_cell_length_a 3.38571
_cell_length_b 6.57776
_cell_length_c 6.57712
_cell_angle_alpha 111.65554
_cell_angle_beta 89.99933
_cell_angle_gamma 89.99989
_cell_volume 136.13692
_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
Eu1 Eu 0.62501 0.24096 0.82958 1.00000
Eu2 Eu 0.62502 0.75355 0.34242 1.00000
Sc1 Sc 0.12501 0.75425 0.82925 1.00000
H1 H 0.12500 0.08500 0.95179 1.00000
H2 H 0.12501 0.55007 0.03327 1.00000
H3 H 0.12502 0.63149 0.49851 1.00000
H4 H 0.62502 0.54764 0.73069 1.00000
H5 H 0.62501 0.85281 0.03595 1.00000
H6 H 0.62501 0.86674 0.71670 1.00000
H7 H 0.51117 0.33268 0.25042 1.00000
H8 H 0.12502 0.05216 0.53101 1.00000
H9 H 0.73870 0.33265 0.25042 1.00000
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