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1. 1. Modeling of non-equilibrium scanning probe microscopy

   Författare :Alexander Gustafsson; Magnus Paulsson; Tchavdar Todorov; Linnéuniversitetet; []
   Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; scanning tunneling microscopy; molecular dynamics; density functional theory; non-equilibrium Green s functions; Condensed Matter Physics; Kondenserade materians fysik;

   Sammanfattning : The work in this thesis is basically divided into two related but separate investigations.The first part treats simple chemical reactions of adsorbate molecules on metallic surfaces, induced by means of a scanning tunneling probe (STM). The investigation serves as a parameter free extension to existing theories. LÄS MER