Ab initio quantum transport calculations using plane waves

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 72.1K citations

Semiconductors, Engineering, Physics +9

Single-layer MoS2 transistors

Branimir Radisavljevic, Jacopo Brivio, Valentina Giacometti et al. · Nature Nanotechnology · 2011 · 14.5K citations · Full text

Semiconductor Technology, Single-layer Mos2 Transistors, Electrical Engineering +5

The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation

José M. Soler, Emilio Artacho, Julian D. Gale et al. · Journal of Physics Condensed Matter · 2002 · 11.7K citations · Full text

Density-functional method for nonequilibrium electron transport

Mads Brandbyge, José-Luís Mozos, Pablo Ordejón et al. · Physical review. B, Condensed matter · 2002 · 5.6K citations · Full text

Engineering, Computational Chemistry, Electronic Structure +18

Generalized Formula for the Electric Tunnel Effect between Similar Electrodes Separated by a Thin Insulating Film

J.G. Simmons · Journal of Applied Physics · 1963 · 4K citations

Electrical Engineering, Thin Insulating Film, Engineering +12