QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: KavitaRao on January 17, 2012, 12:49

Title: Pptimised parametre
Post by: KavitaRao on January 17, 2012, 12:49

How to get optimised parametre after geting geometry optimised?????

Title: Re: Pptimised parametre
Post by: jai on January 26, 2012, 08:02

Which parameters you are talking about?

kindly make it more clear..

Title: Re: Pptimised parametre
Post by: kstokbro on January 26, 2012, 11:30

Use VNL to inspect the nc file,  the last configuration is the optimized configuration.
You may drop the configuration on the editor or another tool to inspect it.

Title: Re: Pptimised parametre
Post by: POP on January 28, 2012, 08:07

like  diameter, bondlength of nanotube