Home
Surfaces
Bulk Structures
Help
Login
FLi Visualisation
Labels
Spin
White Background
Repeat (N
x
)
1
2
3
4
5
Repeat (N
y
)
1
2
3
4
5
Repeat (N
z
)
1
2
3
4
5
Style
Ball & Stick
Wireframe
Spacefill
Compare
--
Published
Best Calculated: Crystal - PBE + Dispersion (Light)
Best Calculated: Crystal - PBE (Light)
Best Calculated: Crystal - B3LYP (Light)
Best Calculated: Crystal - B3LYP (Tight)
Best Calculated: Crystal - PBE (Tight)
Crystal - B3LYP (Light): [6, 6, 6]
Crystal - B3LYP (Light): [5, 5, 5]
Crystal - B3LYP (Light): [4, 4, 4]
Crystal - B3LYP (Tight): [5, 5, 5]
Crystal - PBE (Light): [4, 4, 4]
Crystal - PBE (Light): [3, 3, 3]
Crystal - PBE (Tight): [4, 4, 4]
Crystal - PBE + Dispersion (Light): [4, 4, 4]
Crystal - PBE + Dispersion (Light): [3, 3, 3]
Animate Comparison
--
Rotate + Translate
Rotate
Translate
Pack Atoms
Bonding Data
IC
C
Min Bond Distance
Bond Tolerance