How to show a dipole of a molecule?
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Andrew Orry
Jul 9, 2020, 8:55:48 PM7/9/20
to MolSoft ICM Knowledge Base
Q.
How to show a dipole of a molecule?
A.
These commands will calculate the charge and then display the dipole:
v = Charge( a_//* )* Xyz( a_//* ) - Sum(Charge(a_//*) )*Mean(
Xyz(a_//* ) )
ct = Mean( Xyz(a_//* ) )
arrow1 = Grob( "ARROW" + 20 , (ct-v/2) // (ct +v/2))
display arrow1
ct = Mean( Xyz(a_//* ) )
arrow1 = Grob( "ARROW" + 20 , (ct-v/2) // (ct +v/2))
display arrow1
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