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TITLE: Identifying the presence of subsurface oxygen on the Ti 3 C 2 MXene using H 2 O as a probe molecule: A DFT study  Full Text
AUTHORS: Gouveia, Jose D.; Gomes, Jose R. B.;
PUBLISHED: 2024, SOURCE: COMPUTATIONAL AND THEORETICAL CHEMISTRY, VOLUME: 1239
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
3
TITLE: Adsorption of Hexoses on the Ti2CO2 MXene
AUTHORS: Gouveia, Jose D.; Gomes, Jose R. B.;
PUBLISHED: 2024, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 128, ISSUE: 47
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
5
TITLE: The dipole moment of alcohols in the liquid phase and in solution
AUTHORS: Jorge, Miguel; Gomes, Jose R. B.; Barrera, Maria Cecilia;
PUBLISHED: 2022, SOURCE: JOURNAL OF MOLECULAR LIQUIDS, VOLUME: 356
INDEXED IN: Scopus WOS CrossRef: 17
IN MY: ORCID
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TITLE: Electrolyte Effects on the Amino Acid Solubility in Water: Solubilitiesof Glycine,L-Leucine,L-Phenylalanine, andL-Aspartic Acid in SaltSolutions of (Na+,K+,NH4(+))/(Cl-,NO3-)
AUTHORS: Aliyeva, Mehriban; Brandao, Paula; Gomes, Jose R. B.; Coutinho, Joao A. P.; Ferreira, Olga; Pinho, Simao P.;
PUBLISHED: 2022, SOURCE: INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, VOLUME: 61, ISSUE: 16
INDEXED IN: Scopus WOS CrossRef: 10
IN MY: ORCID
7
TITLE: CORDATA: an open data management web application to select corrosion inhibitors
AUTHORS: Galvão, TLP; Ferreira, I; Kuznetsova, A; Novell Leruth, G; Song, C; Feiler, C; Lamaka, SV; Rocha, C; Maia, F; Zheludkevich, ML; Gomes, JRB; Tedim, J;
PUBLISHED: 2022, SOURCE: npj Materials Degradation, VOLUME: 6, ISSUE: 1
INDEXED IN: Scopus CrossRef: 14
IN MY: ORCID
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TITLE: The effect of atomic point charges on adsorption isotherms of CO2 and water in metal organic frameworks (vol 26, pg 663, 2020)  Full Text
AUTHORS: Sladekova, K; Campbell, C; Grant, C; Fletcher, AJ; Gomes, JRB; Jorge, M;
PUBLISHED: 2021, SOURCE: ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY
INDEXED IN: WOS
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TITLE: Concepts, models, and methods in computational heterogeneous catalysis illustrated through CO2 conversion
AUTHORS: Morales García, Á; Viñes, F; Gomes, JRB; Illas, F;
PUBLISHED: 2021, SOURCE: Wiley Interdisciplinary Reviews: Computational Molecular Science
INDEXED IN: Scopus
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TITLE: Concepts, models, and methods in computational heterogeneous catalysis illustrated through CO2 conversion  Full Text
AUTHORS: Morales Garcia, A; Vines, F; Gomes, JRB; Illas, F;
PUBLISHED: 2021, SOURCE: WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
INDEXED IN: WOS
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