Nd3(YTm)2
Alexandria ALEXAlex-ID: agm003306299 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_210_spg12
NdY2 YTm2 Nd
2022-02-04 00:36:00.742776
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003306299).
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 agm003306299
data_agm003306299
_cell_length_a 3.52584
_cell_length_b 8.56741
_cell_length_c 8.96591
_cell_angle_alpha 118.07732
_cell_angle_beta 101.33964
_cell_angle_gamma 90.00000
_cell_volume 232.95256
_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
Nd1 Nd 0.00000 0.50000 0.00000 1.00000
Nd2 Nd 0.21304 0.80079 0.42608 1.00000
Nd3 Nd 0.78696 0.19921 0.57392 1.00000
Y1 Y 0.85726 0.68001 0.71452 1.00000
Y2 Y 0.14274 0.31999 0.28548 1.00000
Tm1 Tm 0.56441 0.90869 0.12882 1.00000
Tm2 Tm 0.43559 0.09131 0.87118 1.00000
Get direct link