Y6TmC8
Alexandria ALEXAlex-ID: agm072933893 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_385_spg2
Y4C5 Tm3C4 Y2C
2024-10-05 13:19:06.275988
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072933893).
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 agm072933893
data_agm072933893
_cell_length_a 6.18718
_cell_length_b 6.28884
_cell_length_c 6.95647
_cell_angle_alpha 88.54036
_cell_angle_beta 104.70006
_cell_angle_gamma 101.60084
_cell_volume 256.37606
_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
Y1 Y 0.70620 0.46684 0.89573 1.00000
Y2 Y 0.42625 0.92149 0.74383 1.00000
Y3 Y 0.91049 0.70557 0.36604 1.00000
Y4 Y 0.29380 0.53316 0.10427 1.00000
Y5 Y 0.57375 0.07851 0.25617 1.00000
Y6 Y 0.08951 0.29443 0.63396 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
C1 C 0.91821 0.80484 0.69769 1.00000
C2 C 0.08179 0.19516 0.30231 1.00000
C3 C 0.64922 0.77774 0.06948 1.00000
C4 C 0.78089 0.93831 0.60565 1.00000
C5 C 0.05788 0.66875 0.78554 1.00000
C6 C 0.35078 0.22226 0.93052 1.00000
C7 C 0.21911 0.06169 0.39435 1.00000
C8 C 0.94212 0.33125 0.21446 1.00000
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