Ho3(NpTi)2
Alexandria ALEXAlex-ID: agm009799124 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_22_spg12
Ho Np Ti
2024-04-20 07:44:55.299542
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009799124).
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 agm009799124
data_agm009799124
_cell_length_a 3.48443
_cell_length_b 6.44930
_cell_length_c 8.00258
_cell_angle_alpha 102.78163
_cell_angle_beta 89.99108
_cell_angle_gamma 105.66290
_cell_volume 168.52657
_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 0.00000 0.00000 0.00000 1.00000
Ho2 Ho 0.12366 0.24694 0.42926 1.00000
Ho3 Ho 0.87634 0.75306 0.57074 1.00000
Np1 Np 0.26751 0.53493 0.90706 1.00000
Np2 Np 0.73249 0.46507 0.09294 1.00000
Ti1 Ti 0.40254 0.80506 0.25947 1.00000
Ti2 Ti 0.59746 0.19494 0.74053 1.00000
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