Periodic Hartree-Fock Calculations of the Adsorption of Small Molecules on TiO2

Minot, Christian; Fahmi, Adil; Ahdjoudj, Jamila

doi:10.1007/978-94-011-0133-2_17

The Synergy Between Dynamics and Reactivity at Clusters and Surfaces 1995

DOI: 10.1007/978-94-011-0133-2_17

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Periodic Hartree-Fock Calculations of the Adsorption of Small Molecules on TiO2

Christian Minot¹,

Adil Fahmi²,

Jamila Ahdjoudj³

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Cited by 3 publications

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Periodic Hartree-Fock Calculations of the Adsorption of Small Molecules on TiO2

Cited by 3 publications

References 48 publications

Electron-count control on adsorption upon reducible and irreducible clean metal-oxide surfaces

Electron-count control on adsorption upon reducible and irreducible clean metal-oxide surfaces

Adsorption of chlorine and oxygen atoms on clean and defective rutile–TiO2 (110) and MgO (100) surfaces

Hartree–Fock periodic study of the chemisorption of small molecules on TiO2 and MgO surfaces

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