Rinaa Ramesh

3 Questions 1 Answers 0 Followers

Questions related from Rinaa Ramesh

How to overcome this Gaussian 09 error ?

Greetings Everyone!! " Convergence failure -- run terminated. Error termination via Lnk1e in /opt/gaussian/g09/l502.exe at Fri Jan 25 02:26:36 2019. Job cpu time: 1 days 9 hours 9 minutes 45.6...

01 January 2019 8,354 1 View

Error: segmentation violation in Gaussian. How to solve this issue?

Hello everyone, Below is the error i obtained on the log file as Gaussian output. " Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 G2DrvN: will do 41 centers...

12 December 2018 7,950 2 View

What is Electronic Potential Energy Density?

Greetings everyone! I am doing a research on disaccharide glycolipid, a sugar molecule. I did optimization and frequency calculation on the sugar molecule via Gaussian. In order to discover the...

10 October 2018 8,870 4 View