Sunwoo Kang

4 Questions 74 Answers 0 Followers

Questions related from Sunwoo Kang

Is it possible to synthesize the hemicage structure based on tri-carbene?

Dear. researchgate members I wanna to ask you guys who majored organic chemistry. I have read few papers about tripodal carbene complexes (as called hemicage structure). I only have seen...

09 September 2017 7,510 0 View

Can anyone help with doublet to doublet excitation in TDDFT?

This is some curiosity for TDDFT calculation in gaussian 09. Recently, I have tried to calculate doublet to doublet transition property using TDDFT option in gaussian 09. There is only option for...

03 March 2014 9,651 2 View

Is there anyone who has experience in site energy corrected transfer integral in gaussian 09 programs?

I have already known that ADF program can perform this calculation but I just want to know how to obtain transfer integral in gaussian 09 program.

02 February 2014 5,130 0 View

Imaginary frequency of first exicted state geometry

I have got a serious problem during the calculation of excited state geometry using gaussian 09 program. (TDDFT) I've obtained one imaginary frequency when i perform the frequency calculation,...

12 December 2012 4,944 7 View