Physisorption of helium on a TiO 2(110) surface: Periodic and finite cluster approaches

Chemical Physics

Volumn 399, Issue , 2012, Pages 272-280

  De Lara Castells, María Pilar ^a   Aguirre, Néstor F ^a   Mitrushchenkov, Alexander O ^b  

^a INSTITUTO DE FÍSICA FUNDAMENTAL   (Spain)

^b Université Paris Est Créteil   (France)

Author keywords

Basis set superposition error; Embedding; Finite cluster approach; Helium; Many body symmetry adapted perturbation theory; Metal oxide surfaces; Periodic density functional calculations; Physisorption; Rutile TiO 2(110) surface; Wannier orbitals; Wave function based correlated methods

Indexed keywords

EID: 84861342802     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2011.07.013     Document Type: Article

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