Positions and magnetic moments of all atoms in unit cell, with magnetic moment relations explicitly given:
Magnetic atoms:
Set of atoms in the unit cell related by symmetry with the magnetic atom Co1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.33333 | 0.66667 | 0.25000 | mx,mx,mz | -2.20000 | -2.20000 | -1.00000 |
2 | 0.66667 | 0.33333 | 0.75000 | mx,mx,mz | -2.20000 | -2.20000 | -1.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,mz | 3.20000 | 4.60000 | 1.50000 |
2 | 0.00000 | 0.00000 | 0.50000 | my,mx,mz | 4.60000 | 3.20000 | 1.50000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.11663 | 0.65642 | 0.16805 |
2 | 0.88337 | 0.34358 | 0.83195 |
3 | 0.34358 | 0.88337 | 0.33195 |
4 | 0.65642 | 0.11663 | 0.66805 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.34358 | 0.46021 | 0.16805 |
2 | 0.65642 | 0.53979 | 0.83195 |
3 | 0.53979 | 0.65642 | 0.33195 |
4 | 0.46021 | 0.34358 | 0.66805 |
Set of atoms in the unit cell related by symmetry with the atom O1_3:
Atom | x | y | z |
1 | 0.53979 | 0.88337 | 0.16805 |
2 | 0.46021 | 0.11663 | 0.83195 |
3 | 0.11663 | 0.46021 | 0.33195 |
4 | 0.88337 | 0.53979 | 0.66805 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.98677 | 0.79113 | 0.08294 |
2 | 0.01323 | 0.20887 | 0.91706 |
3 | 0.20887 | 0.01323 | 0.41706 |
4 | 0.79113 | 0.98677 | 0.58294 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.20887 | 0.19564 | 0.08294 |
2 | 0.79113 | 0.80436 | 0.91706 |
3 | 0.80436 | 0.79113 | 0.41706 |
4 | 0.19564 | 0.20887 | 0.58294 |
Set of atoms in the unit cell related by symmetry with the atom O2_3:
Atom | x | y | z |
1 | 0.80436 | 0.01323 | 0.08294 |
2 | 0.19564 | 0.98677 | 0.91706 |
3 | 0.98677 | 0.19564 | 0.41706 |
4 | 0.01323 | 0.80436 | 0.58294 |
Set of atoms in the unit cell related by symmetry with the atom C1_1:
Atom | x | y | z |
1 | 0.12675 | 0.78982 | 0.12015 |
2 | 0.87325 | 0.21018 | 0.87985 |
3 | 0.21018 | 0.87325 | 0.37985 |
4 | 0.78982 | 0.12675 | 0.62015 |
Set of atoms in the unit cell related by symmetry with the atom C1_2:
Atom | x | y | z |
1 | 0.21018 | 0.33693 | 0.12015 |
2 | 0.78982 | 0.66307 | 0.87985 |
3 | 0.66307 | 0.78982 | 0.37985 |
4 | 0.33693 | 0.21018 | 0.62015 |
Set of atoms in the unit cell related by symmetry with the atom C1_3:
Atom | x | y | z |
1 | 0.66307 | 0.87325 | 0.12015 |
2 | 0.33693 | 0.12675 | 0.87985 |
3 | 0.12675 | 0.33693 | 0.37985 |
4 | 0.87325 | 0.66307 | 0.62015 |
Set of atoms in the unit cell related by symmetry with the atom H1_1:
Atom | x | y | z |
1 | 0.24470 | 0.89520 | 0.11120 |
2 | 0.75530 | 0.10480 | 0.88880 |
3 | 0.10480 | 0.75530 | 0.38880 |
4 | 0.89520 | 0.24470 | 0.61120 |
Set of atoms in the unit cell related by symmetry with the atom H1_2:
Atom | x | y | z |
1 | 0.10480 | 0.34950 | 0.11120 |
2 | 0.89520 | 0.65050 | 0.88880 |
3 | 0.65050 | 0.89520 | 0.38880 |
4 | 0.34950 | 0.10480 | 0.61120 |
Set of atoms in the unit cell related by symmetry with the atom H1_3:
Atom | x | y | z |
1 | 0.65050 | 0.75530 | 0.11120 |
2 | 0.34950 | 0.24470 | 0.88880 |
3 | 0.24470 | 0.34950 | 0.38880 |
4 | 0.75530 | 0.65050 | 0.61120 |
Set of atoms in the unit cell related by symmetry with the atom C2:
Atom | x | y | z |
1 | 0.33333 | 0.66667 | 0.84420 |
2 | 0.66667 | 0.33333 | 0.15580 |
3 | 0.33333 | 0.66667 | 0.65580 |
4 | 0.66667 | 0.33333 | 0.34420 |
Set of atoms in the unit cell related by symmetry with the atom N1_1:
Atom | x | y | z |
1 | 0.72240 | 0.44470 | 0.25000 |
2 | 0.27760 | 0.55530 | 0.75000 |
3 | 0.55530 | 0.27760 | 0.25000 |
4 | 0.44470 | 0.72240 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom N1_2:
Atom | x | y | z |
1 | 0.55530 | 0.27770 | 0.25000 |
2 | 0.44470 | 0.72230 | 0.75000 |
3 | 0.72230 | 0.44470 | 0.25000 |
4 | 0.27770 | 0.55530 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom N1_3:
Atom | x | y | z |
1 | 0.72230 | 0.27760 | 0.25000 |
2 | 0.27770 | 0.72240 | 0.75000 |
[Hide]