PaperToward an alkene hydroamination catalyst: Static and dynamic ab initio DFT studiesHans Martin Senn, Peter E. Blöchl, et al.JACS
PaperFirst-principles calculations of self-diffusion constants in siliconPeter E. Blöchl, Enrico Smargiassi, et al.Physical Review Letters
PaperFinite-temperature characterization of ferrocene from first-principles molecular dynamics simulationsPeter Margl, Karlheinz Schwarz, et al.The Journal of Chemical Physics
PaperHydrogen electrochemistry and stress-induced leakage current in silicaPeter E. Blöchl, James H. StathisPhysical Review Letters
