<div dir="ltr">I have a question on how the contribution of the Hubbard U depends on the pseudopotential. My understanding is that the penalty applied to the total energy with DFT+U is dependent on a projection of a basis set. My question is whether this basis set is determined by the pseudopotential. <div>
<br></div><div>- Zhongnan <br clear="all"><div><br></div>-- <br><div dir="ltr"><div>Zhongnan Xu, PhD Candidate<div><div>Department of Chemical Engineering</div><div>Carnegie Mellon University</div><div><a href="mailto:zhongnanxu@cmu.edu" target="_blank">zhongnanxu@cmu.edu</a></div>
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