this is for holding javascript data
Chuck-Hou Yee edited section_Material_Design_Workflow_The__.tex
almost 8 years ago
Commit id: f07e7d30f1ab6984a7a649d9a7ed8617bc03753f
deletions | additions
diff --git a/section_Material_Design_Workflow_The__.tex b/section_Material_Design_Workflow_The__.tex
index 1d1e1d2..d9e9144 100644
--- a/section_Material_Design_Workflow_The__.tex
+++ b/section_Material_Design_Workflow_The__.tex
...
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.]