Dear everyone, I used vasp 4.6
For berry phase calculations I got the following results in the OUTCAR file. Can any one please tell me the value of "c" here?
Berry-Phase term: <R>bp
<R> = ( 0.00000, 0.00000, 0.00000 ) electrons Angst
+( 37.64302, 0.00000, 0.00000 ) *c
How can I incorporate the second part ?( 37.64302, 0.00000, 0.00000 ) *c? into the first part ?( 0.00000, 0.00000, 0.00000 ) electrons Angst??
How can I obtain the proper <R>bp term?
Thank you very much!
<span class='smallblacktext'>[ Edited ]</span>
What's the meaning of the "*c"term in the OUTCAR of berry phase calculations
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zhangsg
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What's the meaning of the "*c"term in the OUTCAR of berry phase calculations
Last edited by zhangsg on Thu Aug 11, 2011 12:20 pm, edited 1 time in total.
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support_vasp
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Re: What's the meaning of the "*c"term in the OUTCAR of berry phase calculations
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