Chemical Physics · 2015 · 16 citations · 60 references
Natural SciencesMaterials SciencePhysicsElectrochemistryMolecular PhysicsSurface ScienceMembrane PotentialElectrical CouplingGold NanostructuresMolecular Junctions
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Generalized Gradient Approximation Made Simple
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Natural Sciences, Chemistry, Physics +16
Efficient pseudopotentials for plane-wave calculations
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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 · 11.8K citations · Full text
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Alexandre Reily Rocha, Víctor M. García‐Suárez, Steve W. Bailey et al. · Nature Materials · 2005 · 1.3K citations