K3(Na13In24)2

传统材料 TRA

MP-ID: mp-684127 · 空间群: Pm-3n (#223)

Materials Project API

基础信息

化学式

K3(Na13In24)2

MP-ID

mp-684127

元素数

位点数

154

密度

4.6723

g/cm³

体积

4,425.68

Å³

晶胞参数 a

16.4182

晶胞参数 b

16.4182

晶胞参数 c

16.4182

α 角

90.00

β 角

90.00

γ 角

90.00

空间群

Pm-3n

点群

m-3m

晶体系统

Cubic

Bravais 格子

稳定性

Yes

堆积分数

0.5236

能量属性

形成能/原子

-0.13526

eV/atom

能量/原子

-2.35240

eV/atom

凸包距离

0.0000

eV/atom

未修正能量

-2.3524

eV/atom

体积/原子

28.74

Å³

c/a 比

1.0000

电子属性

金属性

金属

带隙

直接带隙

CBM

N/A

磁性属性

磁性

总磁矩

0.0053

μB

磁有序

磁性位点数

磁化强度/体积

0.000000

μB/Å³

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

In · 0.623

元素家族

N/A

溶质分数

0.377

间隙分数

0.000

ROM 混合特征雷达

评级与分类

评级 Tier

评分

0.557

家族

In-rich Multi-Component

基质元素

In · 0.623

关联任务

关联的计算任务 ID（1 个）

aaacbdwe

引用参考

Materials Project 官方页面

https://materialsproject.org/materials/mp-684127

参考引用

The crystal structure and related material properties of K3(Na13In24)2 were obtained from the Materials Project database (MP-ID: mp-684127, 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 | 拖拽旋转 · 滚轮缩放 · 右键平移

原始 CIF 数据

# generated using pymatgen
data_K3(Na13In24)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.41824200
_cell_length_b   16.41824200
_cell_length_c   16.41824200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3(Na13In24)2
_chemical_formula_sum   'K6 Na52 In96'
_cell_volume   4425.67948334
_cell_formula_units_Z   2
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
  K  K0  1  0.50000000  0.50000000  0.00000000  1.0
  K  K1  1  0.50000000  0.00000000  0.50000000  1.0
  K  K2  1  0.00000000  0.50000000  0.50000000  1.0
  K  K3  1  0.50000000  0.00000000  0.00000000  1.0
  K  K4  1  0.00000000  0.00000000  0.50000000  1.0
  K  K5  1  0.00000000  0.50000000  0.00000000  1.0
  Na  Na6  1  0.68908400  0.31091600  0.31091600  1.0
  Na  Na7  1  0.63609700  0.50000000  0.20406800  1.0
  Na  Na8  1  0.63609700  0.50000000  0.79593200  1.0
  Na  Na9  1  0.81091600  0.18908400  0.18908400  1.0
  Na  Na10  1  0.79593200  0.36390300  0.50000000  1.0
  Na  Na11  1  0.86390300  0.29593200  0.00000000  1.0
  Na  Na12  1  0.20406800  0.36390300  0.50000000  1.0
  Na  Na13  1  0.68908400  0.31091600  0.68908400  1.0
  Na  Na14  1  0.79593200  0.63609700  0.50000000  1.0
  Na  Na15  1  0.86390300  0.70406800  0.00000000  1.0
  Na  Na16  1  0.18908400  0.81091600  0.81091600  1.0
  Na  Na17  1  0.81091600  0.81091600  0.18908400  1.0
  Na  Na18  1  0.36390300  0.50000000  0.79593200  1.0
  Na  Na19  1  0.18908400  0.18908400  0.81091600  1.0
  Na  Na20  1  0.20406800  0.63609700  0.50000000  1.0
  Na  Na21  1  0.81091600  0.18908400  0.81091600  1.0
  Na  Na22  1  0.00000000  0.75000000  0.50000000  1.0
  Na  Na23  1  0.50000000  0.20406800  0.63609700  1.0
  Na  Na24  1  0.31091600  0.68908400  0.68908400  1.0
  Na  Na25  1  0.50000000  0.79593200  0.63609700  1.0
  Na  Na26  1  0.25000000  0.00000000  0.50000000  1.0
  Na  Na27  1  0.50000000  0.20406800  0.36390300  1.0
  Na  Na28  1  0.68908400  0.68908400  0.31091600  1.0
  Na  Na29  1  0.00000000  0.50000000  0.75000000  1.0
  Na  Na30  1  0.70406800  0.00000000  0.86390300  1.0
  Na  Na31  1  0.00000000  0.13609700  0.70406800  1.0
  Na  Na32  1  0.50000000  0.75000000  0.00000000  1.0
  Na  Na33  1  0.29593200  0.00000000  0.86390300  1.0
  Na  Na34  1  0.00000000  0.50000000  0.25000000  1.0
  Na  Na35  1  0.31091600  0.31091600  0.68908400  1.0
  Na  Na36  1  0.25000000  0.50000000  0.00000000  1.0
  Na  Na37  1  0.13609700  0.29593200  0.00000000  1.0
  Na  Na38  1  0.29593200  0.00000000  0.13609700  1.0
  Na  Na39  1  0.81091600  0.81091600  0.81091600  1.0
  Na  Na40  1  0.18908400  0.18908400  0.18908400  1.0
  Na  Na41  1  0.31091600  0.31091600  0.31091600  1.0
  Na  Na42  1  0.00000000  0.13609700  0.29593200  1.0
  Na  Na43  1  0.13609700  0.70406800  0.00000000  1.0
  Na  Na44  1  0.00000000  0.25000000  0.50000000  1.0
  Na  Na45  1  0.75000000  0.00000000  0.50000000  1.0
  Na  Na46  1  0.50000000  0.25000000  0.00000000  1.0
  Na  Na47  1  0.36390300  0.50000000  0.20406800  1.0
  Na  Na48  1  0.50000000  0.00000000  0.75000000  1.0
  Na  Na49  1  0.50000000  0.00000000  0.25000000  1.0
  Na  Na50  1  0.70406800  0.00000000  0.13609700  1.0
  Na  Na51  1  0.68908400  0.68908400  0.68908400  1.0
  Na  Na52  1  0.50000000  0.79593200  0.36390300  1.0
  Na  Na53  1  0.31091600  0.68908400  0.31091600  1.0
  Na  Na54  1  0.18908400  0.81091600  0.18908400  1.0
  Na  Na55  1  0.00000000  0.86390300  0.29593200  1.0
  Na  Na56  1  0.75000000  0.50000000  0.00000000  1.0
  Na  Na57  1  0.00000000  0.86390300  0.70406800  1.0
  In  In58  1  0.16675600  0.82989000  0.59506800  1.0
  In  In59  1  0.09293600  0.00000000  0.15368200  1.0
  In  In60  1  0.50000000  0.59293600  0.65368200  1.0
  In  In61  1  0.09293600  0.00000000  0.84631800  1.0
  In  In62  1  0.33324400  0.09506800  0.32989000  1.0
  In  In63  1  0.00000000  0.15368200  0.90706400  1.0
  In  In64  1  0.40706400  0.34631800  0.50000000  1.0
  In  In65  1  0.67011000  0.66675600  0.90493200  1.0
  In  In66  1  0.17011000  0.59506800  0.16675600  1.0
  In  In67  1  0.40706400  0.65368200  0.50000000  1.0
  In  In68  1  0.82989000  0.59506800  0.83324400  1.0
  In  In69  1  0.66675600  0.90493200  0.67011000  1.0
  In  In70  1  0.66260300  0.18098400  0.50000000  1.0
  In  In71  1  0.15368200  0.90706400  0.00000000  1.0
  In  In72  1  0.34631800  0.50000000  0.40706400  1.0
  In  In73  1  0.33739700  0.18098400  0.50000000  1.0
  In  In74  1  0.59506800  0.16675600  0.82989000  1.0
  In  In75  1  0.40493200  0.16675600  0.17011000  1.0
  In  In76  1  0.33324400  0.90493200  0.67011000  1.0
  In  In77  1  0.40493200  0.16675600  0.82989000  1.0
  In  In78  1  0.32989000  0.66675600  0.90493200  1.0
  In  In79  1  0.83739700  0.00000000  0.68098400  1.0
  In  In80  1  0.17011000  0.40493200  0.83324400  1.0
  In  In81  1  0.59506800  0.83324400  0.82989000  1.0
  In  In82  1  0.65368200  0.50000000  0.59293600  1.0
  In  In83  1  0.32989000  0.33324400  0.09506800  1.0
  In  In84  1  0.50000000  0.40706400  0.34631800  1.0
  In  In85  1  0.16260300  0.00000000  0.31901600  1.0
  In  In86  1  0.67011000  0.33324400  0.09506800  1.0
  In  In87  1  0.67011000  0.66675600  0.09506800  1.0
  In  In88  1  0.18098400  0.50000000  0.33739700  1.0
  In  In89  1  0.50000000  0.59293600  0.34631800  1.0
  In  In90  1  0.68098400  0.16260300  0.00000000  1.0
  In  In91  1  0.90706400  0.00000000  0.15368200  1.0
  In  In92  1  0.68098400  0.83739700  0.00000000  1.0
  In  In93  1  0.66675600  0.90493200  0.32989000  1.0
  In  In94  1  0.65368200  0.50000000  0.40706400  1.0
  In  In95  1  0.50000000  0.66260300  0.81901600  1.0
  In  In96  1  0.59293600  0.34631800  0.50000000  1.0
  In  In97  1  0.15368200  0.09293600  0.00000000  1.0
  In  In98  1  0.09506800  0.67011000  0.66675600  1.0
  In  In99  1  0.09506800  0.67011000  0.33324400  1.0
  In  In100  1  0.83324400  0.17011000  0.40493200  1.0
  In  In101  1  0.16675600  0.82989000  0.40493200  1.0
  In  In102  1  0.50000000  0.33739700  0.18098400  1.0
  In  In103  1  0.40493200  0.83324400  0.82989000  1.0
  In  In104  1  0.31901600  0.83739700  0.00000000  1.0
  In  In105  1  0.90493200  0.67011000  0.66675600  1.0
  In  In106  1  0.90493200  0.32989000  0.33324400  1.0
  In  In107  1  0.82989000  0.59506800  0.16675600  1.0
  In  In108  1  0.81901600  0.50000000  0.66260300  1.0
  In  In109  1  0.90493200  0.67011000  0.33324400  1.0
  In  In110  1  0.83324400  0.82989000  0.59506800  1.0
  In  In111  1  0.00000000  0.84631800  0.09293600  1.0
  In  In112  1  0.90493200  0.32989000  0.66675600  1.0
  In  In113  1  0.00000000  0.15368200  0.09293600  1.0
  In  In114  1  0.50000000  0.66260300  0.18098400  1.0
  In  In115  1  0.82989000  0.40493200  0.83324400  1.0
  In  In116  1  0.50000000  0.33739700  0.81901600  1.0
  In  In117  1  0.00000000  0.68098400  0.16260300  1.0
  In  In118  1  0.16260300  0.00000000  0.68098400  1.0
  In  In119  1  0.84631800  0.09293600  0.00000000  1.0
  In  In120  1  0.16675600  0.17011000  0.59506800  1.0
  In  In121  1  0.32989000  0.66675600  0.09506800  1.0
  In  In122  1  0.83324400  0.17011000  0.59506800  1.0
  In  In123  1  0.17011000  0.40493200  0.16675600  1.0
  In  In124  1  0.66675600  0.09506800  0.32989000  1.0
  In  In125  1  0.82989000  0.40493200  0.16675600  1.0
  In  In126  1  0.32989000  0.33324400  0.90493200  1.0
  In  In127  1  0.66260300  0.81901600  0.50000000  1.0
  In  In128  1  0.16675600  0.17011000  0.40493200  1.0
  In  In129  1  0.66675600  0.09506800  0.67011000  1.0
  In  In130  1  0.90706400  0.00000000  0.84631800  1.0
  In  In131  1  0.33324400  0.90493200  0.32989000  1.0
  In  In132  1  0.18098400  0.50000000  0.66260300  1.0
  In  In133  1  0.59506800  0.16675600  0.17011000  1.0
  In  In134  1  0.83739700  0.00000000  0.31901600  1.0
  In  In135  1  0.00000000  0.84631800  0.90706400  1.0
  In  In136  1  0.34631800  0.50000000  0.59293600  1.0
  In  In137  1  0.33739700  0.81901600  0.50000000  1.0
  In  In138  1  0.00000000  0.31901600  0.83739700  1.0
  In  In139  1  0.00000000  0.31901600  0.16260300  1.0
  In  In140  1  0.17011000  0.59506800  0.83324400  1.0
  In  In141  1  0.59506800  0.83324400  0.17011000  1.0
  In  In142  1  0.00000000  0.68098400  0.83739700  1.0
  In  In143  1  0.67011000  0.33324400  0.90493200  1.0
  In  In144  1  0.09506800  0.32989000  0.66675600  1.0
  In  In145  1  0.31901600  0.16260300  0.00000000  1.0
  In  In146  1  0.84631800  0.90706400  0.00000000  1.0
  In  In147  1  0.59293600  0.65368200  0.50000000  1.0
  In  In148  1  0.33324400  0.09506800  0.67011000  1.0
  In  In149  1  0.50000000  0.40706400  0.65368200  1.0
  In  In150  1  0.83324400  0.82989000  0.40493200  1.0
  In  In151  1  0.40493200  0.83324400  0.17011000  1.0
  In  In152  1  0.81901600  0.50000000  0.33739700  1.0
  In  In153  1  0.09506800  0.32989000  0.33324400  1.0

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