Phillip V. Smith
University of Newcastle
105 Papers
994 Citations
Phillip V. Smith is an academic researcher from University of Newcastle. The author has contributed to research in topics: Chemisorption & Density functional theory. The author has an hindex of 23, co-authored 105 publications. Previous affiliations of Phillip V. Smith include University of Sydney.
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Papers
Structures of small hydrocarbons adsorbed on Si(001) and Si terminated β-SiC(001)
B.I. Craig,Phillip V. Smith +1 more
TL;DR: In this article, a theoretical examination of the adsorption of hydrocarbons atop Si(001), and silicon terminated β-SiC(001) is presented, in which the addition of a hydrocarbon species on top of each silicon dimer of the originally clean (2 × 1) silicon terminated substrate is examined.
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The stable configurations for oxygen chemisorption on the diamond (100) and (111) surfaces
Xiaoming Zheng,Phillip V. Smith +1 more
TL;DR: In this paper, the SLAB-MINDO molecular orbital method was used to study the structures resulting from oxygen chemisorption onto the diamond (100) and (111) ideal and reconstructed surfaces.
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The surface structure of β-SiC(100): The clean and monohydride 2 × 1 phases
B.I. Craig,Phillip V. Smith +1 more
TL;DR: In this paper, the SLAB-MINDO method has been employed to determine the topologies of the 2 × 1 clean and monohydride structures of the β-SiC(100) surfaces.
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A molecular dynamics study of the chemisorption of C2H2 and CH3 on the SI(001)-(2 × 1) surface
A.J. Dyson,Phillip V. Smith +1 more
TL;DR: In this article, the authors used the extended Brenner potential (EBN) to simulate the chemisorption of C 2 H 2 and CH 3 molecules onto the dimerized (001) surface of silicon.
46
Water on silicon (001): C defects and initial steps of surface oxidation
Oliver Warschkow,Steven R. Schofield,Nigel A. Marks,Marian W. Radny,Phillip V. Smith,David R. McKenzie +5 more
TL;DR: In this paper, the authors examined the dynamical properties of the C defect at elevated temperatures (450 K) and established the missing mechanistic link between dissociative water adsorption and wet surface oxidation.
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