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Pptimised parametre
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Topic: Pptimised parametre (Read 3428 times)
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KavitaRao
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Pptimised parametre
«
on:
January 17, 2012, 12:49 »
How to get optimised parametre after geting geometry optimised?
?
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jai
Regular QuantumATK user
Posts: 21
Reputation: 2
Re: Pptimised parametre
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Reply #1 on:
January 26, 2012, 08:02 »
Which parameters you are talking about?
kindly make it more clear..
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kstokbro
Supreme QuantumATK Wizard
Posts: 392
Reputation: 13
Re: Pptimised parametre
«
Reply #2 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.
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POP
Regular QuantumATK user
Posts: 7
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Re: Pptimised parametre
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Reply #3 on:
January 28, 2012, 08:07 »
like diameter, bondlength of nanotube
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Pptimised parametre