Pm2Tm7Tc2
Alexandria ALEXAlex-ID: agm005570545 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C7_367_spg44
PmTm2 Tm3Tc Pm
2023-06-05 03:15:58.173560
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005570545).
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 agm005570545
data_agm005570545
_cell_length_a 3.51640
_cell_length_b 10.85080
_cell_length_c 10.85080
_cell_angle_alpha 50.47913
_cell_angle_beta 80.67502
_cell_angle_gamma 80.67501
_cell_volume 314.20612
_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
Pm1 Pm 0.75625 0.82447 0.66303 1.00000
Pm2 Pm 0.24375 0.33697 0.17553 1.00000
Tm1 Tm 0.86505 0.01991 0.24999 1.00000
Tm2 Tm 0.88840 0.38516 0.83804 1.00000
Tm3 Tm 0.50000 0.04139 0.95861 1.00000
Tm4 Tm 0.58034 0.51562 0.32369 1.00000
Tm5 Tm 0.41966 0.67631 0.48438 1.00000
Tm6 Tm 0.13495 0.75001 0.98009 1.00000
Tm7 Tm 0.11160 0.16196 0.61484 1.00000
Tc1 Tc 1.00000 0.79806 0.20194 1.00000
Tc2 Tc 0.50000 0.34401 0.65599 1.00000
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