ambient condition

Total energy, geometry optimization, DFT+U, spin....

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bahaar
Posts: 30
Joined: Mon Apr 18, 2011 9:18 am

ambient condition

Post by bahaar » Sun May 20, 2012 11:08 pm

Hi every body
How can I do my calculation in ambient condition?Are there variables for tempreture and pressure?
Thanks alot.
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