Nd3Si4Pt7
Alexandria ALEXAlex-ID: agm005694502 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C7_8_spg12
NdSiPt2 NdSiPt3 Nd(SiPt)2
2023-06-29 17:22:45.932970
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005694502).
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 agm005694502
data_agm005694502
_cell_length_a 4.10803
_cell_length_b 8.13533
_cell_length_c 8.39809
_cell_angle_alpha 71.07046
_cell_angle_beta 75.84292
_cell_angle_gamma 75.37564
_cell_volume 252.79543
_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 0.32729 0.17445 0.17096 1.00000
Nd2 Nd 0.67271 0.82555 0.82904 1.00000
Nd3 Nd 0.00000 0.50000 0.50000 1.00000
Si1 Si 0.66830 0.44020 0.22320 1.00000
Si2 Si 0.33170 0.55980 0.77680 1.00000
Si3 Si 0.88966 0.89573 0.32494 1.00000
Si4 Si 0.11034 0.10427 0.67506 1.00000
Pt1 Pt 0.30568 0.84577 0.54287 1.00000
Pt2 Pt 0.49226 0.25065 0.76484 1.00000
Pt3 Pt 0.83120 0.41963 0.91797 1.00000
Pt4 Pt 0.69432 0.15423 0.45713 1.00000
Pt5 Pt 0.16880 0.58037 0.08203 1.00000
Pt6 Pt 0.00000 0.00000 0.00000 1.00000
Pt7 Pt 0.50774 0.74935 0.23516 1.00000
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