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about B,O, and N pseudopotential

From: "Wu Rongqin" <g0203654@nus.edu.sg>
To: <forum@abinit.org>
Subject: about B,O, and N pseudopotential
Date: Sat, 25 Sep 2004 11:58:54 +0800

Dear all,

When I try to do calculation with B, O, and N pseudopotentials, I find that the calculation cannot get converged. The pps are download from the abinit website (TM-normconserving)

And one can point out the problem? I changed k-mesh, ecut. But still failed.

Thanks

Rongqin

about B,O, and N pseudopotential, Wu Rongqin, 09/25/2004
- Re: [abinit-forum] about B,O, and N pseudopotential, Steven Homolya, 09/27/2004