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1
Are both symmetric and buckled dimers on Si-(100) minima? Density functional and multireference perturbation theory calculations

Jung, Yousung; Shao, YH; Gordon, MS; Doren, DJ; Head-Gordon, M, JOURNAL OF CHEMICAL PHYSICS, v.119, no.20, pp.10917 - 10923, 2003-11

2
Development and Validation of a ReaxFF Reactive Force Field for Cu Cation/Water Interactions and Copper Metal/Metal Oxide/Metal Hydroxide Condensed Phases

van Duin, ACT; Bryantsev, VS; Diallo, Mamadou S; Goddard, WA; Rahaman, O; Doren, DJ; Raymand, D; et al, JOURNAL OF PHYSICAL CHEMISTRY A, v.114, no.35, pp.9507 - 9514, 2010-09

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