Ho19(Tm2Sc3)2
Alexandria ALEXAlex-ID: agm005722012 · Space group: I23 (#197)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B6C19_1_spg197
Ho7Tm2 Ho Sc
2023-07-03 14:41:39.085776
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005722012).
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 agm005722012
data_agm005722012
_cell_length_a 10.55440
_cell_length_b 10.55801
_cell_length_c 10.55629
_cell_angle_alpha 109.49497
_cell_angle_beta 109.47395
_cell_angle_gamma 109.48684
_cell_volume 905.06334
_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
Ho1 Ho 0.73452 0.99991 0.73460 1.00000
Ho2 Ho 0.26552 0.00011 0.26542 1.00000
Ho3 Ho 0.26541 0.26545 0.00006 1.00000
Ho4 Ho 0.73462 0.73461 0.99998 1.00000
Ho5 Ho 0.99994 0.73462 0.73457 1.00000
Ho6 Ho 0.00007 0.26543 0.26549 1.00000
Ho7 Ho 1.00000 1.00000 1.00000 1.00000
Ho8 Ho 0.21351 0.22194 0.55382 1.00000
Ho9 Ho 0.78668 0.34037 0.00863 1.00000
Ho10 Ho 0.66801 0.65960 0.44605 1.00000
Ho11 Ho 0.00859 0.78667 0.34038 1.00000
Ho12 Ho 0.33180 0.77803 0.99141 1.00000
Ho13 Ho 0.55390 0.21362 0.22191 1.00000
Ho14 Ho 0.99142 0.33176 0.77806 1.00000
Ho15 Ho 0.44603 0.66793 0.65964 1.00000
Ho16 Ho 0.77807 0.99147 0.33183 1.00000
Ho17 Ho 0.34040 0.00855 0.78665 1.00000
Ho18 Ho 0.22191 0.55378 0.21347 1.00000
Ho19 Ho 0.65957 0.44611 0.66800 1.00000
Tm1 Tm 0.99998 0.99999 0.64354 1.00000
Tm2 Tm 0.99999 0.64353 0.99997 1.00000
Tm3 Tm 0.35642 0.35643 0.35641 1.00000
Tm4 Tm 0.64355 0.99997 0.00001 1.00000
Sc1 Sc 0.38188 0.50008 0.88212 1.00000
Sc2 Sc 0.61814 0.49994 0.11792 1.00000
Sc3 Sc 0.11789 0.61813 0.49981 1.00000
Sc4 Sc 0.88215 0.38190 0.50020 1.00000
Sc5 Sc 0.50004 0.88203 0.38189 1.00000
Sc6 Sc 0.49999 0.11805 0.61816 1.00000
