Material:

ZrCo6

ID:

MMD-506

Explore database:

Compounds with the same formula: ZrCo6 (9 entries found)
Compounds with the same elements: Zr-Co (42 entries found)
Navigation:
Space group | Lattice parameters | Thermodynamic properties | Phase diagram | Magnetic properties | Atomic positions and site-specific magnetic data | Pair-wise magnetic data | Methods | References

Space group:

Crystal system

tetragonal

Space group number

139

Hermann-Mauguin

I4/mmm

Hall

-I 4 2

Point group

mmm

Structure data:

Normalized formula

ZrCo6

The number of formula units per unit cell

6

The total number of atoms per unit cell

42

The number of inequivalent sites per unit cell

4

Structure search

AGA search

Lattice parameters:

a (Å)

8.5902

b (Å)

4.6640

c (Å)

13.5818

α (deg.)

90.000

β (deg.)

108.372

γ (deg.)

90.000

Volume (Å3)

516.415

Density (g/cm3)

8.582

Crystal structure visualization:

Thermodynamic properties:

DFT calculations (details)

Formation energy (vs. elemental phases)

-114.8 meV/atom

Formation energy above hull

48.7 meV/atom

Phase diagram:

Phase diagram

Related structures:

Compounds with the same formula: ZrCo6

9 entries found

Compounds with the same elements: Zr-Co

42 entries found

Magnetic properties:

DFT calculations (details)

Magnetic ordering

Ferromagnetic

Total magnetic moment

48.56 μB/cell

Averaged magnetic moment

1.16 μB/atom

Magnetic polarization, Js = μ0Ms

1.10 T (= 875.4 emu/cm3)
LMTO-GF calculations (details)

Curie temperature, TC

DFT calculations (details)

Magnetic anisotropy constant, Ka-c

-0.00 MJ/m3 (= -0.00 meV/cell)

Magnetic anisotropy constant, Kb-c

1.59 MJ/m3 (= 5.14 meV/cell)

Magnetic anisotropy constant, Kb-a

1.59 MJ/m3 (= 5.14 meV/cell)

Magnetic easy axis

a

Magnetic hardness parameter, κ

0.01

Atomic positions (fractional coordinates) and site-specific magnetic data:

index species w x y z m (μB) Esoc100 (meV) Esoc001 (meV)
1 Co 12h 0.268750 0.000000 0.536000 1.42 . .
2 Co 12h 0.731250 0.000000 0.464000 1.42 . .
3 Co 12h 0.768750 0.500000 0.536000 1.42 . .
4 Co 12h 0.231250 0.500000 0.464000 1.42 . .
5 Co 12h 0.860440 0.000000 0.333280 1.41 . .
6 Co 12h 0.139560 0.000000 0.666720 1.41 . .
7 Co 12h 0.360440 0.500000 0.333280 1.41 . .
8 Co 12h 0.639560 0.500000 0.666720 1.41 . .
9 Co 12h 0.195750 0.000000 0.000090 1.42 . .
10 Co 12h 0.804250 0.000000 0.999910 1.42 . .
11 Co 12h 0.695750 0.500000 0.000090 1.42 . .
12 Co 12h 0.304250 0.500000 0.999910 1.42 . .
13 Co 12h 0.064290 0.000000 0.130650 1.42 . .
14 Co 12h 0.935710 0.000000 0.869350 1.42 . .
15 Co 12h 0.564290 0.500000 0.130650 1.42 . .
16 Co 12h 0.435710 0.500000 0.869350 1.42 . .
17 Co 12h -0.000000 0.750360 0.500000 1.62 . .
18 Co 12h -0.000000 0.249640 0.500000 1.62 . .
19 Co 12h 0.500000 0.250360 0.500000 1.62 . .
20 Co 12h 0.500000 0.749640 0.500000 1.62 . .
21 Co 12h 0.831770 0.249810 0.166680 1.61 . .
22 Co 12h 0.168230 0.750190 0.833320 1.61 . .
23 Co 12h 0.168230 0.249810 0.833320 1.61 . .
24 Co 12h 0.831770 0.750190 0.166680 1.61 . .
25 Co 12d 0.331770 0.749810 0.166680 1.61 . .
26 Co 12d 0.668230 0.250190 0.833320 1.61 . .
27 Co 12d 0.668230 0.749810 0.833320 1.61 . .
28 Co 12d 0.331770 0.250190 0.166680 1.61 . .
29 Co 12d 0.469070 0.000000 0.333360 1.42 . .
30 Co 12d 0.530930 0.000000 0.666640 1.42 . .
31 Co 12d 0.969070 0.500000 0.333360 1.42 . .
32 Co 12d 0.030930 0.500000 0.666640 1.42 . .
33 Co 12d 0.400490 0.000000 0.797330 1.42 . .
34 Co 12d 0.599510 0.000000 0.202670 1.42 . .
35 Co 12d 0.900490 0.500000 0.797330 1.42 . .
36 Co 12d 0.099510 0.500000 0.202670 1.42 . .
37 Zr 6b 0.000000 0.500000 0.000000 -0.24 . .
38 Zr 6b 0.500000 0.000000 0.000000 -0.24 . .
39 Zr 6b 0.835460 0.000000 0.666700 -0.24 . .
40 Zr 6b 0.164540 0.000000 0.333300 -0.24 . .
41 Zr 6b 0.335460 0.500000 0.666700 -0.24 . .
42 Zr 6b 0.664540 0.500000 0.333300 -0.24 . .
w: site multiplicity (the number of equivalent positions) and Wyckoff letter (a label for site symmetry)
m: local magnetic moment
Esoc100 (001): Spin-orbit coupling energy for the magnetization oriented along the crystallographic a (c) axis
(Individual Esoc values are temporarily not available while we perform maintenance.)
Terms and conditions

Site-resolved magnetic moments:

Local magnetic moments

Pair-wise magnetic data:

site i site j distance (Å) Jij (meV)
1 Co 12h 2 Co 12h 4.38 .
1 Co 12h 3 Co 12h 4.89 .
1 Co 12h 4 Co 12h 2.51 .
1 Co 12h 5 Co 12h 3.71 .
1 Co 12h 6 Co 12h 2.37 .
1 Co 12h 7 Co 12h 3.87 .
1 Co 12h 8 Co 12h 3.90 .
1 Co 12h 9 Co 12h 6.53 .
1 Co 12h 10 Co 12h 6.53 .
1 Co 12h 11 Co 12h 6.64 .
1 Co 12h 12 Co 12h 6.63 .
1 Co 12h 13 Co 12h 5.22 .
1 Co 12h 14 Co 12h 6.07 .
1 Co 12h 15 Co 12h 7.14 .
1 Co 12h 16 Co 12h 4.89 .
1 Co 12h 17 Co 12h 2.49 .
1 Co 12h 18 Co 12h 2.49 .
1 Co 12h 19 Co 12h 2.48 .
1 Co 12h 20 Co 12h 2.48 .
1 Co 12h 21 Co 12h 5.36 .
1 Co 12h 22 Co 12h 4.54 .
1 Co 12h 23 Co 12h 4.54 .
1 Co 12h 24 Co 12h 5.36 .
1 Co 12h 25 Co 12d 5.34 .
1 Co 12h 26 Co 12d 4.55 .
1 Co 12h 27 Co 12d 4.55 .
1 Co 12h 28 Co 12d 5.34 .
1 Co 12h 29 Co 12d 3.68 .
1 Co 12h 30 Co 12d 2.39 .
1 Co 12h 31 Co 12d 3.90 .
1 Co 12h 32 Co 12d 3.88 .
1 Co 12h 33 Co 12d 3.37 .
1 Co 12h 34 Co 12d 6.06 .
1 Co 12h 35 Co 12d 5.93 .
1 Co 12h 36 Co 12d 4.89 .
1 Co 12h 37 Zr 6b 7.29 .
1 Co 12h 38 Zr 6b 5.98 .
1 Co 12h 39 Zr 6b 4.60 .
1 Co 12h 40 Zr 6b 2.61 .
1 Co 12h 41 Zr 6b 2.88 .
1 Co 12h 42 Zr 6b 5.52 .
2 Co 12h 3 Co 12h 2.51 .
2 Co 12h 4 Co 12h 4.89 .
2 Co 12h 5 Co 12h 2.37 .
2 Co 12h 6 Co 12h 3.71 .
2 Co 12h 7 Co 12h 3.90 .
2 Co 12h 8 Co 12h 3.87 .
2 Co 12h 9 Co 12h 6.53 .
2 Co 12h 10 Co 12h 6.53 .
2 Co 12h 11 Co 12h 6.63 .
2 Co 12h 12 Co 12h 6.64 .
2 Co 12h 13 Co 12h 6.07 .
2 Co 12h 14 Co 12h 5.22 .
2 Co 12h 15 Co 12h 4.89 .
2 Co 12h 16 Co 12h 7.14 .
2 Co 12h 17 Co 12h 2.49 .
2 Co 12h 18 Co 12h 2.49 .
2 Co 12h 19 Co 12h 2.48 .
2 Co 12h 20 Co 12h 2.48 .
2 Co 12h 21 Co 12h 4.54 .
2 Co 12h 22 Co 12h 5.36 .
2 Co 12h 23 Co 12h 5.36 .
2 Co 12h 24 Co 12h 4.54 .
2 Co 12h 25 Co 12d 4.55 .
2 Co 12h 26 Co 12d 5.34 .
2 Co 12h 27 Co 12d 5.34 .
2 Co 12h 28 Co 12d 4.55 .
2 Co 12h 29 Co 12d 2.39 .
2 Co 12h 30 Co 12d 3.68 .
2 Co 12h 31 Co 12d 3.88 .
2 Co 12h 32 Co 12d 3.90 .
2 Co 12h 33 Co 12d 6.06 .
2 Co 12h 34 Co 12d 3.37 .
2 Co 12h 35 Co 12d 4.89 .
2 Co 12h 36 Co 12d 5.93 .
2 Co 12h 37 Zr 6b 7.29 .
2 Co 12h 38 Zr 6b 5.98 .
2 Co 12h 39 Zr 6b 2.61 .
2 Co 12h 40 Zr 6b 4.60 .
2 Co 12h 41 Zr 6b 5.52 .
2 Co 12h 42 Zr 6b 2.88 .
3 Co 12h 4 Co 12h 4.38 .
3 Co 12h 5 Co 12h 3.87 .
3 Co 12h 6 Co 12h 3.90 .
3 Co 12h 7 Co 12h 3.71 .
3 Co 12h 8 Co 12h 2.37 .
3 Co 12h 9 Co 12h 6.64 .
3 Co 12h 10 Co 12h 6.63 .
3 Co 12h 11 Co 12h 6.53 .
3 Co 12h 12 Co 12h 6.53 .
3 Co 12h 13 Co 12h 7.14 .
3 Co 12h 14 Co 12h 4.89 .
3 Co 12h 15 Co 12h 5.22 .
3 Co 12h 16 Co 12h 6.07 .
3 Co 12h 17 Co 12h 2.48 .
3 Co 12h 18 Co 12h 2.48 .
3 Co 12h 19 Co 12h 2.49 .
3 Co 12h 20 Co 12h 2.49 .
3 Co 12h 21 Co 12h 5.34 .
3 Co 12h 22 Co 12h 4.55 .
3 Co 12h 23 Co 12h 4.55 .
3 Co 12h 24 Co 12h 5.34 .
3 Co 12h 25 Co 12d 5.36 .
3 Co 12h 26 Co 12d 4.54 .
3 Co 12h 27 Co 12d 4.54 .
3 Co 12h 28 Co 12d 5.36 .
3 Co 12h 29 Co 12d 3.90 .
3 Co 12h 30 Co 12d 3.88 .
3 Co 12h 31 Co 12d 3.68 .
3 Co 12h 32 Co 12d 2.39 .
3 Co 12h 33 Co 12d 5.93 .
3 Co 12h 34 Co 12d 4.89 .
3 Co 12h 35 Co 12d 3.37 .
3 Co 12h 36 Co 12d 6.06 .
3 Co 12h 37 Zr 6b 5.98 .
3 Co 12h 38 Zr 6b 7.29 .
3 Co 12h 39 Zr 6b 2.88 .
3 Co 12h 40 Zr 6b 5.52 .
3 Co 12h 41 Zr 6b 4.60 .
3 Co 12h 42 Zr 6b 2.61 .
4 Co 12h 5 Co 12h 3.90 .
4 Co 12h 6 Co 12h 3.87 .
4 Co 12h 7 Co 12h 2.37 .
4 Co 12h 8 Co 12h 3.71 .
4 Co 12h 9 Co 12h 6.63 .
4 Co 12h 10 Co 12h 6.64 .
4 Co 12h 11 Co 12h 6.53 .
4 Co 12h 12 Co 12h 6.53 .
4 Co 12h 13 Co 12h 4.89 .
4 Co 12h 14 Co 12h 7.14 .
4 Co 12h 15 Co 12h 6.07 .
4 Co 12h 16 Co 12h 5.22 .
4 Co 12h 17 Co 12h 2.48 .
4 Co 12h 18 Co 12h 2.48 .
4 Co 12h 19 Co 12h 2.49 .
4 Co 12h 20 Co 12h 2.49 .
4 Co 12h 21 Co 12h 4.55 .
4 Co 12h 22 Co 12h 5.34 .
4 Co 12h 23 Co 12h 5.34 .
4 Co 12h 24 Co 12h 4.55 .
4 Co 12h 25 Co 12d 4.54 .
4 Co 12h 26 Co 12d 5.36 .
4 Co 12h 27 Co 12d 5.36 .
4 Co 12h 28 Co 12d 4.54 .
4 Co 12h 29 Co 12d 3.88 .
4 Co 12h 30 Co 12d 3.90 .
4 Co 12h 31 Co 12d 2.39 .
4 Co 12h 32 Co 12d 3.68 .
4 Co 12h 33 Co 12d 4.89 .
4 Co 12h 34 Co 12d 5.93 .
4 Co 12h 35 Co 12d 6.06 .
4 Co 12h 36 Co 12d 3.37 .
4 Co 12h 37 Zr 6b 5.98 .
4 Co 12h 38 Zr 6b 7.29 .
4 Co 12h 39 Zr 6b 5.52 .
4 Co 12h 40 Zr 6b 2.88 .
4 Co 12h 41 Zr 6b 2.61 .
4 Co 12h 42 Zr 6b 4.60 .
5 Co 12h 6 Co 12h 4.41 .
5 Co 12h 7 Co 12h 4.89 .
5 Co 12h 8 Co 12h 5.91 .
5 Co 12h 9 Co 12h 6.07 .
5 Co 12h 10 Co 12h 4.40 .
5 Co 12h 11 Co 12h 4.89 .
5 Co 12h 12 Co 12h 5.93 .
5 Co 12h 13 Co 12h 3.70 .
5 Co 12h 14 Co 12h 6.53 .
5 Co 12h 15 Co 12h 3.88 .
5 Co 12h 16 Co 12h 6.63 .
5 Co 12h 17 Co 12h 2.49 .
5 Co 12h 18 Co 12h 2.49 .
5 Co 12h 19 Co 12h 4.53 .
5 Co 12h 20 Co 12h 4.53 .
5 Co 12h 21 Co 12h 2.49 .
5 Co 12h 22 Co 12h 6.57 .
5 Co 12h 23 Co 12h 6.57 .
5 Co 12h 24 Co 12h 2.49 .
5 Co 12h 25 Co 12d 4.54 .
5 Co 12h 26 Co 12d 6.57 .
5 Co 12h 27 Co 12d 6.57 .
5 Co 12h 28 Co 12d 4.54 .
5 Co 12h 29 Co 12d 3.36 .
5 Co 12h 30 Co 12d 6.05 .
5 Co 12h 31 Co 12d 2.51 .
5 Co 12h 32 Co 12d 4.89 .
5 Co 12h 33 Co 12d 6.54 .
5 Co 12h 34 Co 12d 2.38 .
5 Co 12h 35 Co 12d 6.63 .
5 Co 12h 36 Co 12d 3.89 .
5 Co 12h 37 Zr 6b 5.55 .
5 Co 12h 38 Zr 6b 4.61 .
5 Co 12h 39 Zr 6b 4.60 .
5 Co 12h 40 Zr 6b 2.61 .
5 Co 12h 41 Zr 6b 5.56 .
5 Co 12h 42 Zr 6b 2.88 .
6 Co 12h 7 Co 12h 5.91 .
6 Co 12h 8 Co 12h 4.89 .
6 Co 12h 9 Co 12h 4.40 .
6 Co 12h 10 Co 12h 6.07 .
6 Co 12h 11 Co 12h 5.93 .
6 Co 12h 12 Co 12h 4.89 .
6 Co 12h 13 Co 12h 6.53 .
6 Co 12h 14 Co 12h 3.70 .
6 Co 12h 15 Co 12h 6.63 .
6 Co 12h 16 Co 12h 3.88 .
6 Co 12h 17 Co 12h 2.49 .
6 Co 12h 18 Co 12h 2.49 .
6 Co 12h 19 Co 12h 4.53 .
6 Co 12h 20 Co 12h 4.53 .
6 Co 12h 21 Co 12h 6.57 .
6 Co 12h 22 Co 12h 2.49 .
6 Co 12h 23 Co 12h 2.49 .
6 Co 12h 24 Co 12h 6.57 .
6 Co 12h 25 Co 12d 6.57 .
6 Co 12h 26 Co 12d 4.54 .
6 Co 12h 27 Co 12d 4.54 .
6 Co 12h 28 Co 12d 6.57 .
6 Co 12h 29 Co 12d 6.05 .
6 Co 12h 30 Co 12d 3.36 .
6 Co 12h 31 Co 12d 4.89 .
6 Co 12h 32 Co 12d 2.51 .
6 Co 12h 33 Co 12d 2.38 .
6 Co 12h 34 Co 12d 6.54 .
6 Co 12h 35 Co 12d 3.89 .
6 Co 12h 36 Co 12d 6.63 .
6 Co 12h 37 Zr 6b 5.55 .
6 Co 12h 38 Zr 6b 4.61 .
6 Co 12h 39 Zr 6b 2.61 .
6 Co 12h 40 Zr 6b 4.60 .
6 Co 12h 41 Zr 6b 2.88 .
6 Co 12h 42 Zr 6b 5.56 .
7 Co 12h 8 Co 12h 4.41 .
7 Co 12h 9 Co 12h 4.89 .
7 Co 12h 10 Co 12h 5.93 .
7 Co 12h 11 Co 12h 6.07 .
7 Co 12h 12 Co 12h 4.40 .
7 Co 12h 13 Co 12h 3.88 .
7 Co 12h 14 Co 12h 6.63 .
7 Co 12h 15 Co 12h 3.70 .
7 Co 12h 16 Co 12h 6.53 .
7 Co 12h 17 Co 12h 4.53 .
7 Co 12h 18 Co 12h 4.53 .
7 Co 12h 19 Co 12h 2.49 .
7 Co 12h 20 Co 12h 2.49 .
7 Co 12h 21 Co 12h 4.54 .
7 Co 12h 22 Co 12h 6.57 .
7 Co 12h 23 Co 12h 6.57 .
7 Co 12h 24 Co 12h 4.54 .
7 Co 12h 25 Co 12d 2.49 .
7 Co 12h 26 Co 12d 6.57 .
7 Co 12h 27 Co 12d 6.57 .
7 Co 12h 28 Co 12d 2.49 .
7 Co 12h 29 Co 12d 2.51 .
7 Co 12h 30 Co 12d 4.89 .
7 Co 12h 31 Co 12d 3.36 .
7 Co 12h 32 Co 12d 6.05 .
7 Co 12h 33 Co 12d 6.63 .
7 Co 12h 34 Co 12d 3.89 .
7 Co 12h 35 Co 12d 6.54 .
7 Co 12h 36 Co 12d 2.38 .
7 Co 12h 37 Zr 6b 4.61 .
7 Co 12h 38 Zr 6b 5.55 .
7 Co 12h 39 Zr 6b 5.56 .
7 Co 12h 40 Zr 6b 2.88 .
7 Co 12h 41 Zr 6b 4.60 .
7 Co 12h 42 Zr 6b 2.61 .
8 Co 12h 9 Co 12h 5.93 .
8 Co 12h 10 Co 12h 4.89 .
8 Co 12h 11 Co 12h 4.40 .
8 Co 12h 12 Co 12h 6.07 .
8 Co 12h 13 Co 12h 6.63 .
8 Co 12h 14 Co 12h 3.88 .
8 Co 12h 15 Co 12h 6.53 .
8 Co 12h 16 Co 12h 3.70 .
8 Co 12h 17 Co 12h 4.53 .
8 Co 12h 18 Co 12h 4.53 .
8 Co 12h 19 Co 12h 2.49 .
8 Co 12h 20 Co 12h 2.49 .
8 Co 12h 21 Co 12h 6.57 .
8 Co 12h 22 Co 12h 4.54 .
8 Co 12h 23 Co 12h 4.54 .
8 Co 12h 24 Co 12h 6.57 .
8 Co 12h 25 Co 12d 6.57 .
8 Co 12h 26 Co 12d 2.49 .
8 Co 12h 27 Co 12d 2.49 .
8 Co 12h 28 Co 12d 6.57 .
8 Co 12h 29 Co 12d 4.89 .
8 Co 12h 30 Co 12d 2.51 .
8 Co 12h 31 Co 12d 6.05 .
8 Co 12h 32 Co 12d 3.36 .
8 Co 12h 33 Co 12d 3.89 .
8 Co 12h 34 Co 12d 6.63 .
8 Co 12h 35 Co 12d 2.38 .
8 Co 12h 36 Co 12d 6.54 .
8 Co 12h 37 Zr 6b 4.61 .
8 Co 12h 38 Zr 6b 5.55 .
8 Co 12h 39 Zr 6b 2.88 .
8 Co 12h 40 Zr 6b 5.56 .
8 Co 12h 41 Zr 6b 2.61 .
8 Co 12h 42 Zr 6b 4.60 .
9 Co 12h 10 Co 12h 3.36 .
9 Co 12h 11 Co 12h 4.89 .
9 Co 12h 12 Co 12h 2.51 .
9 Co 12h 13 Co 12h 2.38 .
9 Co 12h 14 Co 12h 2.38 .
9 Co 12h 15 Co 12h 3.88 .
9 Co 12h 16 Co 12h 3.89 .
9 Co 12h 17 Co 12h 6.57 .
9 Co 12h 18 Co 12h 6.57 .
9 Co 12h 19 Co 12h 6.57 .
9 Co 12h 20 Co 12h 6.57 .
9 Co 12h 21 Co 12h 4.55 .
9 Co 12h 22 Co 12h 2.49 .
9 Co 12h 23 Co 12h 2.49 .
9 Co 12h 24 Co 12h 4.55 .
9 Co 12h 25 Co 12d 2.49 .
9 Co 12h 26 Co 12d 4.53 .
9 Co 12h 27 Co 12d 4.53 .
9 Co 12h 28 Co 12d 2.49 .
9 Co 12h 29 Co 12d 4.39 .
9 Co 12h 30 Co 12d 6.07 .
9 Co 12h 31 Co 12d 5.94 .
9 Co 12h 32 Co 12d 4.89 .
9 Co 12h 33 Co 12d 3.71 .
9 Co 12h 34 Co 12d 3.69 .
9 Co 12h 35 Co 12d 3.88 .
9 Co 12h 36 Co 12d 3.89 .
9 Co 12h 37 Zr 6b 2.87 .
9 Co 12h 38 Zr 6b 2.61 .
9 Co 12h 39 Zr 6b 4.61 .
9 Co 12h 40 Zr 6b 4.62 .
9 Co 12h 41 Zr 6b 5.55 .
9 Co 12h 42 Zr 6b 5.54 .
10 Co 12h 11 Co 12h 2.51 .
10 Co 12h 12 Co 12h 4.89 .
10 Co 12h 13 Co 12h 2.38 .
10 Co 12h 14 Co 12h 2.38 .
10 Co 12h 15 Co 12h 3.89 .
10 Co 12h 16 Co 12h 3.88 .
10 Co 12h 17 Co 12h 6.57 .
10 Co 12h 18 Co 12h 6.57 .
10 Co 12h 19 Co 12h 6.57 .
10 Co 12h 20 Co 12h 6.57 .
10 Co 12h 21 Co 12h 2.49 .
10 Co 12h 22 Co 12h 4.55 .
10 Co 12h 23 Co 12h 4.55 .
10 Co 12h 24 Co 12h 2.49 .
10 Co 12h 25 Co 12d 4.53 .
10 Co 12h 26 Co 12d 2.49 .
10 Co 12h 27 Co 12d 2.49 .
10 Co 12h 28 Co 12d 4.53 .
10 Co 12h 29 Co 12d 6.07 .
10 Co 12h 30 Co 12d 4.39 .
10 Co 12h 31 Co 12d 4.89 .
10 Co 12h 32 Co 12d 5.94 .
10 Co 12h 33 Co 12d 3.69 .
10 Co 12h 34 Co 12d 3.71 .
10 Co 12h 35 Co 12d 3.89 .
10 Co 12h 36 Co 12d 3.88 .
10 Co 12h 37 Zr 6b 2.87 .
10 Co 12h 38 Zr 6b 2.61 .
10 Co 12h 39 Zr 6b 4.62 .
10 Co 12h 40 Zr 6b 4.61 .
10 Co 12h 41 Zr 6b 5.54 .
10 Co 12h 42 Zr 6b 5.55 .
11 Co 12h 12 Co 12h 3.36 .
11 Co 12h 13 Co 12h 3.88 .
11 Co 12h 14 Co 12h 3.89 .
11 Co 12h 15 Co 12h 2.38 .
11 Co 12h 16 Co 12h 2.38 .
11 Co 12h 17 Co 12h 6.57 .
11 Co 12h 18 Co 12h 6.57 .
11 Co 12h 19 Co 12h 6.57 .
11 Co 12h 20 Co 12h 6.57 .
11 Co 12h 21 Co 12h 2.49 .
11 Co 12h 22 Co 12h 4.53 .
11 Co 12h 23 Co 12h 4.53 .
11 Co 12h 24 Co 12h 2.49 .
11 Co 12h 25 Co 12d 4.55 .
11 Co 12h 26 Co 12d 2.49 .
11 Co 12h 27 Co 12d 2.49 .
11 Co 12h 28 Co 12d 4.55 .
11 Co 12h 29 Co 12d 5.94 .
11 Co 12h 30 Co 12d 4.89 .
11 Co 12h 31 Co 12d 4.39 .
11 Co 12h 32 Co 12d 6.07 .
11 Co 12h 33 Co 12d 3.88 .
11 Co 12h 34 Co 12d 3.89 .
11 Co 12h 35 Co 12d 3.71 .
11 Co 12h 36 Co 12d 3.69 .
11 Co 12h 37 Zr 6b 2.61 .
11 Co 12h 38 Zr 6b 2.87 .
11 Co 12h 39 Zr 6b 5.55 .
11 Co 12h 40 Zr 6b 5.54 .
11 Co 12h 41 Zr 6b 4.61 .
11 Co 12h 42 Zr 6b 4.62 .
12 Co 12h 13 Co 12h 3.89 .
12 Co 12h 14 Co 12h 3.88 .
12 Co 12h 15 Co 12h 2.38 .
12 Co 12h 16 Co 12h 2.38 .
12 Co 12h 17 Co 12h 6.57 .
12 Co 12h 18 Co 12h 6.57 .
12 Co 12h 19 Co 12h 6.57 .
12 Co 12h 20 Co 12h 6.57 .
12 Co 12h 21 Co 12h 4.53 .
12 Co 12h 22 Co 12h 2.49 .
12 Co 12h 23 Co 12h 2.49 .
12 Co 12h 24 Co 12h 4.53 .
12 Co 12h 25 Co 12d 2.49 .
12 Co 12h 26 Co 12d 4.55 .
12 Co 12h 27 Co 12d 4.55 .
12 Co 12h 28 Co 12d 2.49 .
12 Co 12h 29 Co 12d 4.89 .
12 Co 12h 30 Co 12d 5.94 .
12 Co 12h 31 Co 12d 6.07 .
12 Co 12h 32 Co 12d 4.39 .
12 Co 12h 33 Co 12d 3.89 .
12 Co 12h 34 Co 12d 3.88 .
12 Co 12h 35 Co 12d 3.69 .
12 Co 12h 36 Co 12d 3.71 .
12 Co 12h 37 Zr 6b 2.61 .
12 Co 12h 38 Zr 6b 2.87 .
12 Co 12h 39 Zr 6b 5.54 .
12 Co 12h 40 Zr 6b 5.55 .
12 Co 12h 41 Zr 6b 4.62 .
12 Co 12h 42 Zr 6b 4.61 .
13 Co 12h 14 Co 12h 3.37 .
13 Co 12h 15 Co 12h 4.89 .
13 Co 12h 16 Co 12h 5.93 .
13 Co 12h 17 Co 12h 5.35 .
13 Co 12h 18 Co 12h 5.35 .
13 Co 12h 19 Co 12h 5.36 .
13 Co 12h 20 Co 12h 5.36 .
13 Co 12h 21 Co 12h 2.49 .
13 Co 12h 22 Co 12h 4.55 .
13 Co 12h 23 Co 12h 4.55 .
13 Co 12h 24 Co 12h 2.49 .
13 Co 12h 25 Co 12d 2.48 .
13 Co 12h 26 Co 12d 4.54 .
13 Co 12h 27 Co 12d 4.54 .
13 Co 12h 28 Co 12d 2.48 .
13 Co 12h 29 Co 12d 3.69 .
13 Co 12h 30 Co 12d 6.52 .
13 Co 12h 31 Co 12d 3.89 .
13 Co 12h 32 Co 12d 6.64 .
13 Co 12h 33 Co 12d 6.06 .
13 Co 12h 34 Co 12d 4.39 .
13 Co 12h 35 Co 12d 4.89 .
13 Co 12h 36 Co 12d 2.51 .
13 Co 12h 37 Zr 6b 2.88 .
13 Co 12h 38 Zr 6b 4.61 .
13 Co 12h 39 Zr 6b 5.98 .
13 Co 12h 40 Zr 6b 2.61 .
13 Co 12h 41 Zr 6b 7.29 .
13 Co 12h 42 Zr 6b 5.54 .
14 Co 12h 15 Co 12h 5.93 .
14 Co 12h 16 Co 12h 4.89 .
14 Co 12h 17 Co 12h 5.35 .
14 Co 12h 18 Co 12h 5.35 .
14 Co 12h 19 Co 12h 5.36 .
14 Co 12h 20 Co 12h 5.36 .
14 Co 12h 21 Co 12h 4.55 .
14 Co 12h 22 Co 12h 2.49 .
14 Co 12h 23 Co 12h 2.49 .
14 Co 12h 24 Co 12h 4.55 .
14 Co 12h 25 Co 12d 4.54 .
14 Co 12h 26 Co 12d 2.48 .
14 Co 12h 27 Co 12d 2.48 .
14 Co 12h 28 Co 12d 4.54 .
14 Co 12h 29 Co 12d 6.52 .
14 Co 12h 30 Co 12d 3.69 .
14 Co 12h 31 Co 12d 6.64 .
14 Co 12h 32 Co 12d 3.89 .
14 Co 12h 33 Co 12d 4.39 .
14 Co 12h 34 Co 12d 6.06 .
14 Co 12h 35 Co 12d 2.51 .
14 Co 12h 36 Co 12d 4.89 .
14 Co 12h 37 Zr 6b 2.88 .
14 Co 12h 38 Zr 6b 4.61 .
14 Co 12h 39 Zr 6b 2.61 .
14 Co 12h 40 Zr 6b 5.98 .
14 Co 12h 41 Zr 6b 5.54 .
14 Co 12h 42 Zr 6b 7.29 .
15 Co 12h 16 Co 12h 3.37 .
15 Co 12h 17 Co 12h 5.36 .
15 Co 12h 18 Co 12h 5.36 .
15 Co 12h 19 Co 12h 5.35 .
15 Co 12h 20 Co 12h 5.35 .
15 Co 12h 21 Co 12h 2.48 .
15 Co 12h 22 Co 12h 4.54 .
15 Co 12h 23 Co 12h 4.54 .
15 Co 12h 24 Co 12h 2.48 .
15 Co 12h 25 Co 12d 2.49 .
15 Co 12h 26 Co 12d 4.55 .
15 Co 12h 27 Co 12d 4.55 .
15 Co 12h 28 Co 12d 2.49 .
15 Co 12h 29 Co 12d 3.89 .
15 Co 12h 30 Co 12d 6.64 .
15 Co 12h 31 Co 12d 3.69 .
15 Co 12h 32 Co 12d 6.52 .
15 Co 12h 33 Co 12d 4.89 .
15 Co 12h 34 Co 12d 2.51 .
15 Co 12h 35 Co 12d 6.06 .
15 Co 12h 36 Co 12d 4.39 .
15 Co 12h 37 Zr 6b 4.61 .
15 Co 12h 38 Zr 6b 2.88 .
15 Co 12h 39 Zr 6b 7.29 .
15 Co 12h 40 Zr 6b 5.54 .
15 Co 12h 41 Zr 6b 5.98 .
15 Co 12h 42 Zr 6b 2.61 .
16 Co 12h 17 Co 12h 5.36 .
16 Co 12h 18 Co 12h 5.36 .
16 Co 12h 19 Co 12h 5.35 .
16 Co 12h 20 Co 12h 5.35 .
16 Co 12h 21 Co 12h 4.54 .
16 Co 12h 22 Co 12h 2.48 .
16 Co 12h 23 Co 12h 2.48 .
16 Co 12h 24 Co 12h 4.54 .
16 Co 12h 25 Co 12d 4.55 .
16 Co 12h 26 Co 12d 2.49 .
16 Co 12h 27 Co 12d 2.49 .
16 Co 12h 28 Co 12d 4.55 .
16 Co 12h 29 Co 12d 6.64 .
16 Co 12h 30 Co 12d 3.89 .
16 Co 12h 31 Co 12d 6.52 .
16 Co 12h 32 Co 12d 3.69 .
16 Co 12h 33 Co 12d 2.51 .
16 Co 12h 34 Co 12d 4.89 .
16 Co 12h 35 Co 12d 4.39 .
16 Co 12h 36 Co 12d 6.06 .
16 Co 12h 37 Zr 6b 4.61 .
16 Co 12h 38 Zr 6b 2.88 .
16 Co 12h 39 Zr 6b 5.54 .
16 Co 12h 40 Zr 6b 7.29 .
16 Co 12h 41 Zr 6b 2.61 .
16 Co 12h 42 Zr 6b 5.98 .
17 Co 12h 18 Co 12h 2.33 .
17 Co 12h 19 Co 12h 4.89 .
17 Co 12h 20 Co 12h 4.30 .
17 Co 12h 21 Co 12h 4.89 .
17 Co 12h 22 Co 12h 4.30 .
17 Co 12h 23 Co 12h 4.89 .
17 Co 12h 24 Co 12h 4.30 .
17 Co 12h 25 Co 12d 6.06 .
17 Co 12h 26 Co 12d 6.49 .
17 Co 12h 27 Co 12d 6.06 .
17 Co 12h 28 Co 12d 6.49 .
17 Co 12h 29 Co 12d 4.56 .
17 Co 12h 30 Co 12d 4.56 .
17 Co 12h 31 Co 12d 2.49 .
17 Co 12h 32 Co 12d 2.49 .
17 Co 12h 33 Co 12d 4.55 .
17 Co 12h 34 Co 12d 4.55 .
17 Co 12h 35 Co 12d 4.54 .
17 Co 12h 36 Co 12d 4.54 .
17 Co 12h 37 Zr 6b 6.89 .
17 Co 12h 38 Zr 6b 6.89 .
17 Co 12h 39 Zr 6b 3.24 .
17 Co 12h 40 Zr 6b 3.24 .
17 Co 12h 41 Zr 6b 3.27 .
17 Co 12h 42 Zr 6b 3.27 .
18 Co 12h 19 Co 12h 4.30 .
18 Co 12h 20 Co 12h 4.89 .
18 Co 12h 21 Co 12h 4.30 .
18 Co 12h 22 Co 12h 4.89 .
18 Co 12h 23 Co 12h 4.30 .
18 Co 12h 24 Co 12h 4.89 .
18 Co 12h 25 Co 12d 6.49 .
18 Co 12h 26 Co 12d 6.06 .
18 Co 12h 27 Co 12d 6.49 .
18 Co 12h 28 Co 12d 6.06 .
18 Co 12h 29 Co 12d 4.56 .
18 Co 12h 30 Co 12d 4.56 .
18 Co 12h 31 Co 12d 2.49 .
18 Co 12h 32 Co 12d 2.49 .
18 Co 12h 33 Co 12d 4.55 .
18 Co 12h 34 Co 12d 4.55 .
18 Co 12h 35 Co 12d 4.54 .
18 Co 12h 36 Co 12d 4.54 .
18 Co 12h 37 Zr 6b 6.89 .
18 Co 12h 38 Zr 6b 6.89 .
18 Co 12h 39 Zr 6b 3.24 .
18 Co 12h 40 Zr 6b 3.24 .
18 Co 12h 41 Zr 6b 3.27 .
18 Co 12h 42 Zr 6b 3.27 .
19 Co 12h 20 Co 12h 2.33 .
19 Co 12h 21 Co 12h 6.06 .
19 Co 12h 22 Co 12h 6.49 .
19 Co 12h 23 Co 12h 6.06 .
19 Co 12h 24 Co 12h 6.49 .
19 Co 12h 25 Co 12d 4.89 .
19 Co 12h 26 Co 12d 4.30 .
19 Co 12h 27 Co 12d 4.89 .
19 Co 12h 28 Co 12d 4.30 .
19 Co 12h 29 Co 12d 2.49 .
19 Co 12h 30 Co 12d 2.49 .
19 Co 12h 31 Co 12d 4.56 .
19 Co 12h 32 Co 12d 4.56 .
19 Co 12h 33 Co 12d 4.54 .
19 Co 12h 34 Co 12d 4.54 .
19 Co 12h 35 Co 12d 4.55 .
19 Co 12h 36 Co 12d 4.55 .
19 Co 12h 37 Zr 6b 6.89 .
19 Co 12h 38 Zr 6b 6.89 .
19 Co 12h 39 Zr 6b 3.27 .
19 Co 12h 40 Zr 6b 3.27 .
19 Co 12h 41 Zr 6b 3.24 .
19 Co 12h 42 Zr 6b 3.24 .
20 Co 12h 21 Co 12h 6.49 .
20 Co 12h 22 Co 12h 6.06 .
20 Co 12h 23 Co 12h 6.49 .
20 Co 12h 24 Co 12h 6.06 .
20 Co 12h 25 Co 12d 4.30 .
20 Co 12h 26 Co 12d 4.89 .
20 Co 12h 27 Co 12d 4.30 .
20 Co 12h 28 Co 12d 4.89 .
20 Co 12h 29 Co 12d 2.49 .
20 Co 12h 30 Co 12d 2.49 .
20 Co 12h 31 Co 12d 4.56 .
20 Co 12h 32 Co 12d 4.56 .
20 Co 12h 33 Co 12d 4.54 .
20 Co 12h 34 Co 12d 4.54 .
20 Co 12h 35 Co 12d 4.55 .
20 Co 12h 36 Co 12d 4.55 .
20 Co 12h 37 Zr 6b 6.89 .
20 Co 12h 38 Zr 6b 6.89 .
20 Co 12h 39 Zr 6b 3.27 .
20 Co 12h 40 Zr 6b 3.27 .
20 Co 12h 41 Zr 6b 3.24 .
20 Co 12h 42 Zr 6b 3.24 .
21 Co 12h 22 Co 12h 6.49 .
21 Co 12h 23 Co 12h 6.06 .
21 Co 12h 24 Co 12h 2.33 .
21 Co 12h 25 Co 12d 4.89 .
21 Co 12h 26 Co 12d 4.30 .
21 Co 12h 27 Co 12d 4.89 .
21 Co 12h 28 Co 12d 4.30 .
21 Co 12h 29 Co 12d 4.54 .
21 Co 12h 30 Co 12d 6.56 .
21 Co 12h 31 Co 12d 2.49 .
21 Co 12h 32 Co 12d 6.56 .
21 Co 12h 33 Co 12d 5.34 .
21 Co 12h 34 Co 12d 2.49 .
21 Co 12h 35 Co 12d 5.36 .
21 Co 12h 36 Co 12d 2.49 .
21 Co 12h 37 Zr 6b 3.26 .
21 Co 12h 38 Zr 6b 3.25 .
21 Co 12h 39 Zr 6b 6.88 .
21 Co 12h 40 Zr 6b 3.25 .
21 Co 12h 41 Zr 6b 6.88 .
21 Co 12h 42 Zr 6b 3.26 .
22 Co 12h 23 Co 12h 2.33 .
22 Co 12h 24 Co 12h 6.06 .
22 Co 12h 25 Co 12d 4.30 .
22 Co 12h 26 Co 12d 4.89 .
22 Co 12h 27 Co 12d 4.30 .
22 Co 12h 28 Co 12d 4.89 .
22 Co 12h 29 Co 12d 6.56 .
22 Co 12h 30 Co 12d 4.54 .
22 Co 12h 31 Co 12d 6.56 .
22 Co 12h 32 Co 12d 2.49 .
22 Co 12h 33 Co 12d 2.49 .
22 Co 12h 34 Co 12d 5.34 .
22 Co 12h 35 Co 12d 2.49 .
22 Co 12h 36 Co 12d 5.36 .
22 Co 12h 37 Zr 6b 3.26 .
22 Co 12h 38 Zr 6b 3.25 .
22 Co 12h 39 Zr 6b 3.25 .
22 Co 12h 40 Zr 6b 6.88 .
22 Co 12h 41 Zr 6b 3.26 .
22 Co 12h 42 Zr 6b 6.88 .
23 Co 12h 24 Co 12h 6.49 .
23 Co 12h 25 Co 12d 4.89 .
23 Co 12h 26 Co 12d 4.30 .
23 Co 12h 27 Co 12d 4.89 .
23 Co 12h 28 Co 12d 4.30 .
23 Co 12h 29 Co 12d 6.56 .
23 Co 12h 30 Co 12d 4.54 .
23 Co 12h 31 Co 12d 6.56 .
23 Co 12h 32 Co 12d 2.49 .
23 Co 12h 33 Co 12d 2.49 .
23 Co 12h 34 Co 12d 5.34 .
23 Co 12h 35 Co 12d 2.49 .
23 Co 12h 36 Co 12d 5.36 .
23 Co 12h 37 Zr 6b 3.26 .
23 Co 12h 38 Zr 6b 3.25 .
23 Co 12h 39 Zr 6b 3.25 .
23 Co 12h 40 Zr 6b 6.88 .
23 Co 12h 41 Zr 6b 3.26 .
23 Co 12h 42 Zr 6b 6.88 .
24 Co 12h 25 Co 12d 4.30 .
24 Co 12h 26 Co 12d 4.89 .
24 Co 12h 27 Co 12d 4.30 .
24 Co 12h 28 Co 12d 4.89 .
24 Co 12h 29 Co 12d 4.54 .
24 Co 12h 30 Co 12d 6.56 .
24 Co 12h 31 Co 12d 2.49 .
24 Co 12h 32 Co 12d 6.56 .
24 Co 12h 33 Co 12d 5.34 .
24 Co 12h 34 Co 12d 2.49 .
24 Co 12h 35 Co 12d 5.36 .
24 Co 12h 36 Co 12d 2.49 .
24 Co 12h 37 Zr 6b 3.26 .
24 Co 12h 38 Zr 6b 3.25 .
24 Co 12h 39 Zr 6b 6.88 .
24 Co 12h 40 Zr 6b 3.25 .
24 Co 12h 41 Zr 6b 6.88 .
24 Co 12h 42 Zr 6b 3.26 .
25 Co 12d 26 Co 12d 6.49 .
25 Co 12d 27 Co 12d 6.06 .
25 Co 12d 28 Co 12d 2.33 .
25 Co 12d 29 Co 12d 2.49 .
25 Co 12d 30 Co 12d 6.56 .
25 Co 12d 31 Co 12d 4.54 .
25 Co 12d 32 Co 12d 6.56 .
25 Co 12d 33 Co 12d 5.36 .
25 Co 12d 34 Co 12d 2.49 .
25 Co 12d 35 Co 12d 5.34 .
25 Co 12d 36 Co 12d 2.49 .
25 Co 12d 37 Zr 6b 3.25 .
25 Co 12d 38 Zr 6b 3.26 .
25 Co 12d 39 Zr 6b 6.88 .
25 Co 12d 40 Zr 6b 3.26 .
25 Co 12d 41 Zr 6b 6.88 .
25 Co 12d 42 Zr 6b 3.25 .
26 Co 12d 27 Co 12d 2.33 .
26 Co 12d 28 Co 12d 6.06 .
26 Co 12d 29 Co 12d 6.56 .
26 Co 12d 30 Co 12d 2.49 .
26 Co 12d 31 Co 12d 6.56 .
26 Co 12d 32 Co 12d 4.54 .
26 Co 12d 33 Co 12d 2.49 .
26 Co 12d 34 Co 12d 5.36 .
26 Co 12d 35 Co 12d 2.49 .
26 Co 12d 36 Co 12d 5.34 .
26 Co 12d 37 Zr 6b 3.25 .
26 Co 12d 38 Zr 6b 3.26 .
26 Co 12d 39 Zr 6b 3.26 .
26 Co 12d 40 Zr 6b 6.88 .
26 Co 12d 41 Zr 6b 3.25 .
26 Co 12d 42 Zr 6b 6.88 .
27 Co 12d 28 Co 12d 6.49 .
27 Co 12d 29 Co 12d 6.56 .
27 Co 12d 30 Co 12d 2.49 .
27 Co 12d 31 Co 12d 6.56 .
27 Co 12d 32 Co 12d 4.54 .
27 Co 12d 33 Co 12d 2.49 .
27 Co 12d 34 Co 12d 5.36 .
27 Co 12d 35 Co 12d 2.49 .
27 Co 12d 36 Co 12d 5.34 .
27 Co 12d 37 Zr 6b 3.25 .
27 Co 12d 38 Zr 6b 3.26 .
27 Co 12d 39 Zr 6b 3.26 .
27 Co 12d 40 Zr 6b 6.88 .
27 Co 12d 41 Zr 6b 3.25 .
27 Co 12d 42 Zr 6b 6.88 .
28 Co 12d 29 Co 12d 2.49 .
28 Co 12d 30 Co 12d 6.56 .
28 Co 12d 31 Co 12d 4.54 .
28 Co 12d 32 Co 12d 6.56 .
28 Co 12d 33 Co 12d 5.36 .
28 Co 12d 34 Co 12d 2.49 .
28 Co 12d 35 Co 12d 5.34 .
28 Co 12d 36 Co 12d 2.49 .
28 Co 12d 37 Zr 6b 3.25 .
28 Co 12d 38 Zr 6b 3.26 .
28 Co 12d 39 Zr 6b 6.88 .
28 Co 12d 40 Zr 6b 3.26 .
28 Co 12d 41 Zr 6b 6.88 .
28 Co 12d 42 Zr 6b 3.25 .
29 Co 12d 30 Co 12d 4.39 .
29 Co 12d 31 Co 12d 4.89 .
29 Co 12d 32 Co 12d 5.95 .
29 Co 12d 33 Co 12d 6.51 .
29 Co 12d 34 Co 12d 2.38 .
29 Co 12d 35 Co 12d 6.65 .
29 Co 12d 36 Co 12d 3.89 .
29 Co 12d 37 Zr 6b 5.54 .
29 Co 12d 38 Zr 6b 4.62 .
29 Co 12d 39 Zr 6b 4.63 .
29 Co 12d 40 Zr 6b 2.62 .
29 Co 12d 41 Zr 6b 5.53 .
29 Co 12d 42 Zr 6b 2.87 .
30 Co 12d 31 Co 12d 5.95 .
30 Co 12d 32 Co 12d 4.89 .
30 Co 12d 33 Co 12d 2.38 .
30 Co 12d 34 Co 12d 6.51 .
30 Co 12d 35 Co 12d 3.89 .
30 Co 12d 36 Co 12d 6.65 .
30 Co 12d 37 Zr 6b 5.54 .
30 Co 12d 38 Zr 6b 4.62 .
30 Co 12d 39 Zr 6b 2.62 .
30 Co 12d 40 Zr 6b 4.63 .
30 Co 12d 41 Zr 6b 2.87 .
30 Co 12d 42 Zr 6b 5.53 .
31 Co 12d 32 Co 12d 4.39 .
31 Co 12d 33 Co 12d 6.65 .
31 Co 12d 34 Co 12d 3.89 .
31 Co 12d 35 Co 12d 6.51 .
31 Co 12d 36 Co 12d 2.38 .
31 Co 12d 37 Zr 6b 4.62 .
31 Co 12d 38 Zr 6b 5.54 .
31 Co 12d 39 Zr 6b 5.53 .
31 Co 12d 40 Zr 6b 2.87 .
31 Co 12d 41 Zr 6b 4.63 .
31 Co 12d 42 Zr 6b 2.62 .
32 Co 12d 33 Co 12d 3.89 .
32 Co 12d 34 Co 12d 6.65 .
32 Co 12d 35 Co 12d 2.38 .
32 Co 12d 36 Co 12d 6.51 .
32 Co 12d 37 Zr 6b 4.62 .
32 Co 12d 38 Zr 6b 5.54 .
32 Co 12d 39 Zr 6b 2.87 .
32 Co 12d 40 Zr 6b 5.53 .
32 Co 12d 41 Zr 6b 2.62 .
32 Co 12d 42 Zr 6b 4.63 .
33 Co 12d 34 Co 12d 5.22 .
33 Co 12d 35 Co 12d 4.89 .
33 Co 12d 36 Co 12d 7.14 .
33 Co 12d 37 Zr 6b 5.53 .
33 Co 12d 38 Zr 6b 2.61 .
33 Co 12d 39 Zr 6b 4.61 .
33 Co 12d 40 Zr 6b 5.98 .
33 Co 12d 41 Zr 6b 2.88 .
33 Co 12d 42 Zr 6b 7.29 .
34 Co 12d 35 Co 12d 7.14 .
34 Co 12d 36 Co 12d 4.89 .
34 Co 12d 37 Zr 6b 5.53 .
34 Co 12d 38 Zr 6b 2.61 .
34 Co 12d 39 Zr 6b 5.98 .
34 Co 12d 40 Zr 6b 4.61 .
34 Co 12d 41 Zr 6b 7.29 .
34 Co 12d 42 Zr 6b 2.88 .
35 Co 12d 36 Co 12d 5.22 .
35 Co 12d 37 Zr 6b 2.61 .
35 Co 12d 38 Zr 6b 5.53 .
35 Co 12d 39 Zr 6b 2.88 .
35 Co 12d 40 Zr 6b 7.29 .
35 Co 12d 41 Zr 6b 4.61 .
35 Co 12d 42 Zr 6b 5.98 .
36 Co 12d 37 Zr 6b 2.61 .
36 Co 12d 38 Zr 6b 5.53 .
36 Co 12d 39 Zr 6b 7.29 .
36 Co 12d 40 Zr 6b 2.88 .
36 Co 12d 41 Zr 6b 5.98 .
36 Co 12d 42 Zr 6b 4.61 .
37 Zr 6b 38 Zr 6b 4.89 .
37 Zr 6b 39 Zr 6b 4.89 .
37 Zr 6b 40 Zr 6b 4.89 .
37 Zr 6b 41 Zr 6b 6.07 .
37 Zr 6b 42 Zr 6b 6.07 .
38 Zr 6b 39 Zr 6b 6.07 .
38 Zr 6b 40 Zr 6b 6.07 .
38 Zr 6b 41 Zr 6b 4.89 .
38 Zr 6b 42 Zr 6b 4.89 .
39 Zr 6b 40 Zr 6b 6.05 .
39 Zr 6b 41 Zr 6b 4.89 .
39 Zr 6b 42 Zr 6b 4.89 .
40 Zr 6b 41 Zr 6b 4.89 .
40 Zr 6b 42 Zr 6b 4.89 .
41 Zr 6b 42 Zr 6b 6.05 .
Jij: magnetic exchange parameter between site i and j (Individual Jij values are temporarily not available while we perform maintenance.)
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Terms and conditions

Pair-resolved magnetic exchange parameters:

Exchange coupling parameters

Individual exchange parameters:

Exchange coupling parameters

Methods:

DFT calculations

  • exchange-correlation energy functional: GGA-PBE
  • pseudopotential type: PAW
  • cutoff energy: 65.0 Ry
  • k-point grid: (kx, ky, kz) = (6, 12, 4) for magnetic anisotropy calculations
  • package: QE (v6.3)

LMTO-GF calculations

  • k-point grid: (kx, ky, kz) =
  • energy mesh: 41 points on an elliptical contour
  • package: Questaal (v7)

References:

References

You can download and use the data of this database for your scientific work, provided that you express proper acknowledgements: