Browsing Physics (Scholarly Publications) by Author "CHEN, XIHUA"
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Ab initio study of electron transport in dry poly(G)-poly(C) A-DNA strands
SANVITO, STEFANO; RUNGGER, IVAN; PEMMARAJU, SRI; CHEN, XIHUA (2010)The bias-dependent transport properties of short poly (G)-poly(C) A-DNA strands attached to Au electrodes are investigated with first-principles electronic-transport methods. By using the nonequilibrium Green's function ... -
Finite-bias electronic transport of molecules in a water solution
SANVITO, STEFANO; RUNGGER, IVAN; CHEN, XIHUA (2010)The effects of water wetting conditions on the transport properties of molecular nanojunctions are investigated theoretically by using a combination of empirical-potential molecular-dynamics and first-principles electr ...