Desenho de organosilicas Mesoporosas para Processo de Separação por Adsorção
Logos
tipo de financiamento Fundação para a Ciência e a Tecnologia
programa FCT/PTDC/2008
acrónimo/
referência 		PTDC/EQU-EQU/099423/2008
grupo(s) de investigação 6 - simulação computacional e modelação multi-escala;
2 - nanoestruturas e cerâmicos ferróicos multifuncionais ;
departamento Chemistry (DQ)
período de execução 2010-03-01 - 2013-05-28 ( 39 Meses )
resumo/
palavras-chave 		Adsorption equilibrium
Molecular Simulation
Nanoporous Materials
Biogas Upgrading
coordenador
/ip local 		José R. B. Gomes
ciceco status Parceiro
instituíção proponente Faculdade de Engenharia da Universidade do Porto (FE/UP)
instituições participante(s) Universidade de Aveiro (UA)
participação industrial Não
parceiro(s) internacional Não
orçamento total 140.000€
orçamento ciceco 68.232€
centro de custos 3.89.122
link http://www.fct.pt/apoios/projectos/consulta/vglobal_projecto?idProjecto=99423&idElemConcurso=2758
publicações
Carbonization of periodic mesoporous phenylene- and biphenylene-silicas for CO2/CH4 separation
Lourenco, MAO; Pinto, ML; Pires, J; Gomes, JRB; Ferreira, P
2017, CARBON, 119, 267-277.
Insights into CO2 and CH4 Adsorption by Pristine and Aromatic Amine-Modified Periodic Mesoporous Phenylene-Silicas
Lourenco, MAO; Siquet, C; Santos, J; Jorge, M; Gomes, JRB; Ferreira, P
2016, JOURNAL OF PHYSICAL CHEMISTRY C, 120, 26, 14236-14245.
Interaction of CO2 and CH4 with Functionalized Periodic Mesoporous Phenylene-Silica: Periodic DFT Calculations and Gas Adsorption Measurements
Lourenco, MAO; Siquet, C; Sardo, M; Mafra, L; Pires, J; Jorge, M; Pinto, ML; Ferreira, P; Gomes, JRB
2016, JOURNAL OF PHYSICAL CHEMISTRY C, 120, 7, 3863-3875.
Computational approaches to study adsorption in MOFs with unsaturated metal sites
Fischer, M; Gomes, JRB; Jorge, M
2014, MOLECULAR SIMULATION, 40, 07-Sep, 537-556.
Accurate Model for Predicting Adsorption of Olefins and Paraffins on MOFs with Open Metal Sites
Jorge, M; Fischer, M; Gomes, JRB; Siquet, C; Santos, JC; Rodrigues, AE
2014, INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 53, 40, 15475-15487.
Molecular Simulation of the Adsorption of Methane in Engelhard Titanosilicate Frameworks
Pillai, RS; Gomes, JRB; Jorge, M
2014, LANGMUIR, 30, 25, 7435-7446.
Structures and energetics of organosilanes in the gaseous phase: a computational study
Futamura, R; Jorge, M; Gomes, JRB
2013, THEORETICAL CHEMISTRY ACCOUNTS, 132, 2,
Role of the organic linker in the early stages of the templated synthesis of PMOs
Futamura, R; Jorge, M; Gomes, JRB
2013, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 15, 17, 6166-6169.
Microwave assisted N-alkylation of amine functionalized crystal-like mesoporous phenylene-silica
Lourenco, MAO; Siegel, R; Mafra, L; Ferreira, P
2013, DALTON TRANSACTIONS, 42, 16, 5631-5634.
Modeling Self-Assembly of Silica/Surfactant Mesostructures in the Templated Synthesis of Nanoporous Solids
Perez-Sanchez, G; Gomes, JRB; Jorge, M
2013, LANGMUIR, 29, 7, 2387-2396.
Modeling Adsorption in Metal-Organic Frameworks with Open Metal Sites: Propane/Propylene Separations
Fischer, M; Gomes, JRB; Froba, M; Jorge, M
2012, LANGMUIR, 28, 22, 8537-8549.
Apoio

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