Pm2Er3Tm4
Alexandria ALEXAlex-ID: agm003333710 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_295_spg15
ErTm5 PmEr2 PmTm2
2022-01-30 01:03:34.758426
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003333710).
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 agm003333710
data_agm003333710
_cell_length_a 5.92833
_cell_length_b 11.16171
_cell_length_c 11.16171
_cell_angle_alpha 62.13188
_cell_angle_beta 63.92314
_cell_angle_gamma 63.92315
_cell_volume 560.38775
_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 0.43195 0.28153 0.50760 1.00000
Pm2 Pm 0.06805 0.49240 0.71847 1.00000
Pm3 Pm 0.56805 0.71847 0.49240 1.00000
Pm4 Pm 0.93195 0.50760 0.28153 1.00000
Er1 Er 0.75896 0.01252 0.31552 1.00000
Er2 Er 0.74104 0.68448 0.98748 1.00000
Er3 Er 0.24104 0.98748 0.68448 1.00000
Er4 Er 0.25896 0.31552 0.01252 1.00000
Er5 Er 0.25000 0.65225 0.34775 1.00000
Er6 Er 0.75000 0.34775 0.65225 1.00000
Tm1 Tm 0.42143 0.95504 0.16813 1.00000
Tm2 Tm 0.07857 0.83187 0.04496 1.00000
Tm3 Tm 0.57857 0.04496 0.83187 1.00000
Tm4 Tm 0.92143 0.16813 0.95504 1.00000
Tm5 Tm 0.09396 0.15842 0.37524 1.00000
Tm6 Tm 0.40604 0.62476 0.84158 1.00000
Tm7 Tm 0.90604 0.84158 0.62476 1.00000
Tm8 Tm 0.59396 0.37524 0.15842 1.00000
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