[Wien] LDA-U error for SrVO3 during orb

[Elias Assmann]

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Soumen,

On 06/05/2015 09:40 AM, Soumen Bag wrote:
> This time  i am getting '*Error in Vorb*' at second iteration. I
> used following initializations switch.

You might try giving a little more information … (Error message?
.inorb?  .indm?)

As a wild guess, I conjecture that you forgot the case.indm file.

Also, are you calculating SrVO₃ with LDA+U just to learn the method?
If you are actually interested in results, I should add that the
method does not make much sense for this material.


	Elias


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