Multiwfn forum / C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom

Re: C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom

dummy@example.com (sobereva) — Tue, 22 May 2018 14:12:33 +0000

The quality of RDG and IGM maps are nice

Re: C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom

dummy@example.com (lonemen) — Mon, 21 May 2018 01:06:01 +0000

Thank you for your kind share!

I_was_a_baby wrote:

Theoretical Research of C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom
By I_was_a_baby
Abstract: a series of NLO clusters have been designed by C6H6 and B3N3H6 with alkali metal atoms. Via analysis of a series of wavefunction analysis methods, it can be seen that doping alkali metal atoms can not only improve the nonlinear optical properties of the entire system, but also affect the properties of the doped aromatic system.
1.pdf

C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom

dummy@example.com (I_was_a_baby) — Sun, 20 May 2018 15:17:56 +0000

Theoretical Research of C6H6 and B3N3H6 Aromatic Rings with doping alkali metal atom

By I_was_a_baby

Abstract: a series of NLO clusters have been designed by C6H6 and B3N3H6 with alkali metal atoms. Via analysis of a series of wavefunction analysis methods, it can be seen that doping alkali metal atoms can not only improve the nonlinear optical properties of the entire system, but also affect the properties of the doped aromatic system.

1.pdf