AcCd11

Traditional Materials TRA

MP-ID: mp-3293263 · Space group: Pm-3m (#221)

Materials Project API

Basic Information

Formula

AcCd11

MP-ID

mp-3293263

Elements

Sites

Density

8.6541

g/cm³

Volume

842.45

Å³

Cell a

9.4446

Cell b

9.4446

Cell c

9.4446

α Angle

90.00

β Angle

90.00

γ Angle

90.00

Space Group

Pm-3m

Point Group

m-3m

Crystal System

Cubic

Bravais Lattice

Stability

Yes

Packing Fraction

0.5236

X-ray Diffraction

Diffraction Pattern

Target / Radiation

X-axis: 2θ (°); Y-axis: relative intensity; Cu Kα ; λ=1.5418 Å

Diffraction Peaks (Top 24)

2θ	d (Å)	I	hkl
13.26	6.6783	1.3	(1,1,0)
16.26	5.4528	2.8	(1,1,1)
26.70	3.3392	1.3	(2,2,0)
28.35	3.1482	3.4	(2,2,1)
29.92	2.9866	37.7	(3,1,0)
31.41	2.8476	100.0	(3,1,1)
32.85	2.7264	75.5	(2,2,2)
34.23	2.6195	44.7	(3,2,0)
35.57	2.5242	1.7	(3,2,1)
38.11	2.3611	11.0	(4,0,0)
39.33	2.2906	68.7	(4,1,0)
40.52	2.2261	47.3	(4,1,1)
41.68	2.1667	3.5	(3,3,1)
42.82	2.1119	1.0	(4,2,0)
43.93	2.0610	46.2	(4,2,1)
47.14	1.9279	6.6	(4,2,2)
48.17	1.8889	2.8	(5,0,0)
49.19	1.8522	2.1	(5,1,0)
50.19	1.8176	6.0	(5,1,1)
52.15	1.7538	1.3	(5,2,0)
53.11	1.7243	1.8	(5,2,1)
55.00	1.6696	20.7	(4,4,0)
55.93	1.6441	3.8	(5,2,2)
56.84	1.6197	13.2	(5,3,0)

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Energy Properties

Formation Energy/atom

-0.20299

eV/atom

Energy/atom

-24.35235

eV/atom

Energy above Hull

0.0000

eV/atom

Uncorrected Energy

-24.3523

eV/atom

Volume/atom

23.40

Å³

c/a Ratio

1.0000

Electronic Properties

Metallic

Metal

Band Gap

Direct Gap

CBM

N/A

Magnetic Properties

Magnetic

Total Mag. Moment

0.0024

μB

Mag. Ordering

Mag. Sites

Magnetization/Volume

0.000000

μB/Å³

Elastic Properties

Elastic data not available

Feature Analysis

Composition Overview

Element Composition (atomic fraction)

Composition Info

Major / Matrix Element

Cd · 0.917

Element Family

N/A

Solute Fraction

0.083

Interstitial Fraction

0.000

Traditional Material Features

ROM Blended-Feature Radar

Rating & Classification

Tier

Score

0.603

Family

Binary Alloy

Matrix Element

Cd · 0.917

Related Tasks

Related computation task IDs (1)

aaahfjrz

Citation & References

Materials Project Page

https://materialsproject.org/materials/mp-3293263

Reference Citation

The crystal structure and related material properties of AcCd11 were obtained from the Materials Project database (MP-ID: mp-3293263, database version v2026.04.13).

Literature Citation

Horton, M.K., Huck, P., Yang, R.X. et al. Accelerated data-driven materials science with the Materials Project. Nat. Mater. 24, 1522–1532 (2025). https://doi.org/10.1038/s41563-025-02272-0

3D Crystal Structure Rendering

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Raw CIF Data

# generated using pymatgen
data_AcCd11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.44456857
_cell_length_b   9.44456857
_cell_length_c   9.44456857
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcCd11
_chemical_formula_sum   'Ac3 Cd33'
_cell_volume   842.45434011
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ac  Ac0  1  0.50000000  0.00000000  0.00000000  1.0
  Ac  Ac1  1  0.00000000  0.00000000  0.50000000  1.0
  Ac  Ac2  1  0.00000000  0.50000000  0.00000000  1.0
  Cd  Cd3  1  0.50000000  0.50000000  0.50000000  1.0
  Cd  Cd4  1  0.15676352  0.15676352  0.84323648  1.0
  Cd  Cd5  1  0.15676352  0.84323648  0.15676352  1.0
  Cd  Cd6  1  0.84323648  0.15676352  0.15676352  1.0
  Cd  Cd7  1  0.84323648  0.84323648  0.84323648  1.0
  Cd  Cd8  1  0.84323648  0.84323648  0.15676352  1.0
  Cd  Cd9  1  0.84323648  0.15676352  0.84323648  1.0
  Cd  Cd10  1  0.15676352  0.84323648  0.84323648  1.0
  Cd  Cd11  1  0.15676352  0.15676352  0.15676352  1.0
  Cd  Cd12  1  0.00000000  0.34617136  0.65382864  1.0
  Cd  Cd13  1  0.34617136  0.34617136  0.00000000  1.0
  Cd  Cd14  1  0.34617136  0.00000000  0.65382864  1.0
  Cd  Cd15  1  0.00000000  0.65382864  0.34617136  1.0
  Cd  Cd16  1  0.34617136  0.65382864  0.00000000  1.0
  Cd  Cd17  1  0.34617136  0.00000000  0.34617136  1.0
  Cd  Cd18  1  0.00000000  0.34617136  0.34617136  1.0
  Cd  Cd19  1  0.65382864  0.34617136  0.00000000  1.0
  Cd  Cd20  1  0.65382864  0.00000000  0.34617136  1.0
  Cd  Cd21  1  0.00000000  0.65382864  0.65382864  1.0
  Cd  Cd22  1  0.65382864  0.65382864  0.00000000  1.0
  Cd  Cd23  1  0.65382864  0.00000000  0.65382864  1.0
  Cd  Cd24  1  0.50000000  0.26834338  0.73165662  1.0
  Cd  Cd25  1  0.26834338  0.26834338  0.50000000  1.0
  Cd  Cd26  1  0.26834338  0.50000000  0.73165662  1.0
  Cd  Cd27  1  0.50000000  0.73165662  0.26834338  1.0
  Cd  Cd28  1  0.26834338  0.73165662  0.50000000  1.0
  Cd  Cd29  1  0.26834338  0.50000000  0.26834338  1.0
  Cd  Cd30  1  0.50000000  0.26834338  0.26834338  1.0
  Cd  Cd31  1  0.73165662  0.26834338  0.50000000  1.0
  Cd  Cd32  1  0.73165662  0.50000000  0.26834338  1.0
  Cd  Cd33  1  0.50000000  0.73165662  0.73165662  1.0
  Cd  Cd34  1  0.73165662  0.73165662  0.50000000  1.0
  Cd  Cd35  1  0.73165662  0.50000000  0.73165662  1.0

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