Chuck-Hou Yee edited section_Material_Design_Workflow_The__.tex  almost 8 years ago

Commit id: f07e7d30f1ab6984a7a649d9a7ed8617bc03753f

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say Ce$_2$Pd$_2$Sn, predict its ground state crystal structure. Structure  prediction requires having an accurate method for producing the energy of a  given configuration of atoms. For weakly correlated materials, DFT has been  quite successful successful~\cite{Fredeman_2011, Gautier_2015}  a) Structure to Property [ compute Gaps, Tc’s etc.]