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Sr8Al7

传统材料 TRA

MP-ID: mp-11224 · 空间群: P2_13 (#198)

基础信息

化学式
Sr8Al7
MP-ID
mp-11224
元素数
2
位点数
60
密度
2.8671
g/cm³
体积
2,061.46
ų
晶胞参数 a
12.7270
Å
晶胞参数 b
12.7270
Å
晶胞参数 c
12.7270
Å
α 角
90.00
°
β 角
90.00
°
γ 角
90.00
°
空间群
P2_13
点群
23
晶体系统
Cubic
Bravais 格子
cP
稳定性
No
堆积分数
0.5236

能量属性

形成能/原子
-0.19739
eV/atom
能量/原子
-11.41672
eV/atom
凸包距离
0.0087
eV/atom
未修正能量
-2.8339
eV/atom
体积/原子
34.36
ų
c/a 比
1.0000

电子属性

金属性
金属
带隙
0
eV
直接带隙
No
CBM
N/A
eV

磁性属性

磁性
Yes
总磁矩
4.0754
μB
磁有序
Unknown
磁性位点数
0
磁化强度/体积
0.001980
μB/ų

弹性属性

弹性数据暂不开放

特征分析

元素组成(原子分数)
组成信息
主元 / 基质元素
Sr · 0.533
元素家族
N/A
溶质分数
0.467
间隙分数
0.000
ROM 混合特征雷达
评级与分类
评级 Tier
A
评分
0.631
家族
Binary Alloy
基质元素
Sr · 0.533

关联任务

关联的计算任务 ID(3 个)

引用参考

Materials Project 官方页面
https://materialsproject.org/materials/mp-11224
参考引用

The crystal structure and related material properties of Sr8Al7 were obtained from the Materials Project database (MP-ID: mp-11224, database version v2026.04.13).

文献引用

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

晶体结构 3D 渲染

加载 3D 结构...

样式: Ball & Stick
原始 CIF 数据
# generated using pymatgen
data_Sr8Al7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.72695913
_cell_length_b   12.72695913
_cell_length_c   12.72695913
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr8Al7
_chemical_formula_sum   'Sr32 Al28'
_cell_volume   2061.45542470
_cell_formula_units_Z   4
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
  Sr  Sr0  1  0.81442247  0.81442247  0.81442247  1.0
  Sr  Sr1  1  0.68557753  0.18557753  0.31442247  1.0
  Sr  Sr2  1  0.31442247  0.68557753  0.18557753  1.0
  Sr  Sr3  1  0.18557753  0.31442247  0.68557753  1.0
  Sr  Sr4  1  0.18443576  0.18443576  0.18443576  1.0
  Sr  Sr5  1  0.31556424  0.81556424  0.68443576  1.0
  Sr  Sr6  1  0.68443576  0.31556424  0.81556424  1.0
  Sr  Sr7  1  0.81556424  0.68443576  0.31556424  1.0
  Sr  Sr8  1  0.80238625  0.55938806  0.00575723  1.0
  Sr  Sr9  1  0.00575723  0.80238625  0.55938806  1.0
  Sr  Sr10  1  0.55938806  0.00575723  0.80238625  1.0
  Sr  Sr11  1  0.94061194  0.99424277  0.30238625  1.0
  Sr  Sr12  1  0.50575723  0.69761375  0.44061194  1.0
  Sr  Sr13  1  0.44061194  0.50575723  0.69761375  1.0
  Sr  Sr14  1  0.49424277  0.19761375  0.05938806  1.0
  Sr  Sr15  1  0.99424277  0.30238625  0.94061194  1.0
  Sr  Sr16  1  0.05938806  0.49424277  0.19761375  1.0
  Sr  Sr17  1  0.30238625  0.94061194  0.99424277  1.0
  Sr  Sr18  1  0.19761375  0.05938806  0.49424277  1.0
  Sr  Sr19  1  0.69761375  0.44061194  0.50575723  1.0
  Sr  Sr20  1  0.52300102  0.70311838  0.93695219  1.0
  Sr  Sr21  1  0.93695219  0.52300102  0.70311838  1.0
  Sr  Sr22  1  0.70311838  0.93695219  0.52300102  1.0
  Sr  Sr23  1  0.79688162  0.06304781  0.02300102  1.0
  Sr  Sr24  1  0.43695219  0.97699898  0.29688162  1.0
  Sr  Sr25  1  0.29688162  0.43695219  0.97699898  1.0
  Sr  Sr26  1  0.56304781  0.47699898  0.20311838  1.0
  Sr  Sr27  1  0.06304781  0.02300102  0.79688162  1.0
  Sr  Sr28  1  0.20311838  0.56304781  0.47699898  1.0
  Sr  Sr29  1  0.02300102  0.79688162  0.06304781  1.0
  Sr  Sr30  1  0.47699898  0.20311838  0.56304781  1.0
  Sr  Sr31  1  0.97699898  0.29688162  0.43695219  1.0
  Al  Al32  1  0.43035454  0.43035454  0.43035454  1.0
  Al  Al33  1  0.06964546  0.56964546  0.93035454  1.0
  Al  Al34  1  0.93035454  0.06964546  0.56964546  1.0
  Al  Al35  1  0.56964546  0.93035454  0.06964546  1.0
  Al  Al36  1  0.75342040  0.19094466  0.57727494  1.0
  Al  Al37  1  0.57727494  0.75342040  0.19094466  1.0
  Al  Al38  1  0.19094466  0.57727494  0.75342040  1.0
  Al  Al39  1  0.30905534  0.42272506  0.25342040  1.0
  Al  Al40  1  0.07727494  0.74657960  0.80905534  1.0
  Al  Al41  1  0.80905534  0.07727494  0.74657960  1.0
  Al  Al42  1  0.92272506  0.24657960  0.69094466  1.0
  Al  Al43  1  0.42272506  0.25342040  0.30905534  1.0
  Al  Al44  1  0.69094466  0.92272506  0.24657960  1.0
  Al  Al45  1  0.25342040  0.30905534  0.42272506  1.0
  Al  Al46  1  0.24657960  0.69094466  0.92272506  1.0
  Al  Al47  1  0.74657960  0.80905534  0.07727494  1.0
  Al  Al48  1  0.75132430  0.68636222  0.58144042  1.0
  Al  Al49  1  0.58144042  0.75132430  0.68636222  1.0
  Al  Al50  1  0.68636222  0.58144042  0.75132430  1.0
  Al  Al51  1  0.81363778  0.41855958  0.25132430  1.0
  Al  Al52  1  0.08144042  0.74867570  0.31363778  1.0
  Al  Al53  1  0.31363778  0.08144042  0.74867570  1.0
  Al  Al54  1  0.91855958  0.24867570  0.18636222  1.0
  Al  Al55  1  0.41855958  0.25132430  0.81363778  1.0
  Al  Al56  1  0.18636222  0.91855958  0.24867570  1.0
  Al  Al57  1  0.25132430  0.81363778  0.41855958  1.0
  Al  Al58  1  0.24867570  0.18636222  0.91855958  1.0
  Al  Al59  1  0.74867570  0.31363778  0.08144042  1.0
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