82
TITLE: Selectivity for CO2 over CH4 on a functionalized periodic mesoporous phenylene-silica explained by transition state theory  Full Text
AUTHORS: Christian Kunkel; Francesc Vines; Mirtha A O Lourenco; Paula Ferreira; Jose R B Gomes; Francesc Illas;
PUBLISHED: 2017, SOURCE: CHEMICAL PHYSICS LETTERS, VOLUME: 671
INDEXED IN: Scopus WOS
85
TITLE: Molecular Simulations of the Synthesis of Periodic Mesoporous Silica Phases at High Surfactant Concentrations
AUTHORS: Chien, SC; Perez Sanchez, G; Gomes, JRB; Cordeiro, MNDS ; Jorge, M; Auerbach, SM; Monson, PA;
PUBLISHED: 2017, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 121, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 27
87
TITLE: Adsorption of CO on the rutile TiO2(110) surface: a dispersion-corrected density functional theory study
AUTHORS: Joao P P Prates Ramalho ; Francesc Illas; Jose R B Gomes;
PUBLISHED: 2017, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 19, ISSUE: 3
INDEXED IN: WOS
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