PaperGeneralized separable potentials for electronic-structure calculationsPeter E. BlöchlPhysical Review B
PaperFirst-principles molecular dynamics study of small molecules in zeolitesKarlheinz Schwarz, Ernst Nusterer, et al.Catalysis Today
PaperImproved tetrahedron method for Brillouin-zone integrationsPeter E. Blöchl, O. Jepsen, et al.Physical Review B
