return to home page Computational Chemistry Comparison and Benchmark DataBase Release 18 (October 2016) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Calculated > Electrostatics > Dipole > Dipole calculation types

Electric dipole moments calculated from atom charges compared to dipoles from the wavefunction.

The electric dipole moment is a measure of the charge distribution in a molecule. The calculated dipole moments are reported as an unsigned total dipole and as three cartesians components in units of Debye.
See section
FAQ Help; Units; Choose Units; Dipole and Quadrupole
to change dipole units.

Please enter the chemical formula

Rules for chemical formula

Species in the CCCBDB