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Dy8Co3Ag2

Alexandria ALEX

Alex-ID: agm005642201 · Space group: P2/m (#10)

Basic Information

Formula
Dy8Co3Ag2
Alex-ID
agm005642201
Elements
3
Sites
13
Space group
P2/m (#10)
Crystal system
monoclinic
Volume
331.24
ų
Cell a
4.5166
Å
Cell b
10.1879
Å
Cell c
8.4065
Å
α angle
121.09
°
β angle
90.00
°
γ angle
90.00
°

Composition

Element Composition (atomic fraction)
Composition Info
Formula
Dy8Co3Ag2
Dy
8.00 · 61.5%
Co
3.00 · 23.1%
Ag
2.00 · 15.4%

Energy & Stability

Energy above hull
0.1485
eV/atom
Formation energy
-0.0817
eV/atom
Corrected total energy
-64.9658
eV
Raw total energy
-64.9658
eV

Electronic Structure

Indirect band gap
0.0000
eV
Direct band gap
0.0000
eV
DOS at Fermi level
11.5090
Total magnetisation
0.0000
μB

Additional Information

Prototype ID

A2B3C8_146_spg65

Decomposition

Dy4CoAg DyCo DyAg

Computed at

2023-06-15 17:46:46.962745

Citation

Alexandria website
https://alexandria.icams.rub.de/
Attribution

The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005642201).

Reference

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

BibTeX
@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…

Style: Ball & Stick
Raw CIF Data
# CIF generated by HEAS from Alexandria entry agm005642201
data_agm005642201
_cell_length_a     4.51659
_cell_length_b     10.18791
_cell_length_c     8.40646
_cell_angle_alpha  121.09450
_cell_angle_beta   90.00000
_cell_angle_gamma  90.00001
_cell_volume       331.24028
_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
  Dy1 Dy 0.00000 0.64815 0.21672 1.00000
  Dy2 Dy 1.00000 0.35185 0.78328 1.00000
  Dy3 Dy 1.00000 0.13480 0.22463 1.00000
  Dy4 Dy 0.00000 0.86520 0.77537 1.00000
  Dy5 Dy 0.50000 0.63740 0.82874 1.00000
  Dy6 Dy 0.50000 0.08611 0.73747 1.00000
  Dy7 Dy 0.50000 0.91389 0.26253 1.00000
  Dy8 Dy 0.50000 0.36260 0.17126 1.00000
  Co1 Co 0.50000 0.00000 0.00000 1.00000
  Co2 Co 1.00000 0.19959 0.95805 1.00000
  Co3 Co 0.00000 0.80041 0.04195 1.00000
  Ag1 Ag 0.50000 0.27700 0.50962 1.00000
  Ag2 Ag 0.50000 0.72300 0.49038 1.00000
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