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Page 1
Electronic Structure of Water from Koopmans-Compliant Functionals.
de Almeida JM, Nguyen NL, Colonna N, Chen W, Rodrigues Miranda C, Pasquarello A, Marzari N. de Almeida JM, et al. Among authors: rodrigues miranda c. J Chem Theory Comput. 2021 Jul 13;17(7):3923-3930. doi: 10.1021/acs.jctc.1c00063. Epub 2021 Jun 17. J Chem Theory Comput. 2021. PMID: 34137253
Improved oil recovery in nanopores: NanoIOR.
de Almeida JM, Miranda CR. de Almeida JM, et al. Among authors: miranda cr. Sci Rep. 2016 Jun 20;6:28128. doi: 10.1038/srep28128. Sci Rep. 2016. PMID: 27319357 Free PMC article.
Intercalation of CO2 Selected by Type of Interlayer Cation in Dried Synthetic Hectorite.
Hunvik KWB, Seljelid KK, Wallacher D, Kirch A, Cavalcanti LP, Loch P, Røren PM, Michels-Brito PH, Droppa-Jr R, Knudsen KD, Miranda CR, Breu J, Fossum JO. Hunvik KWB, et al. Among authors: miranda cr. Langmuir. 2023 Apr 11;39(14):4895-4903. doi: 10.1021/acs.langmuir.2c03093. Epub 2023 Mar 29. Langmuir. 2023. PMID: 36989083 Free PMC article.
Application of new nanoparticle structures as catalysts: general discussion.
Baletto F, Boeije M, Bordet A, Brinkert K, Catlow R, Davies J, Dononelli W, Freund HJ, Friend C, Gates B, Genest A, Guan S, Hardacre C, Hargreaves J, Huang H, Hutchings G, Johnston R, Lai S, Lamberti C, Marbaix J, Miranda CR, Nome R, Peron J, Quinson J, Richards N, Roesch N, Russell A, Said S, Selvam P, Sermon P, Shozi M, Skylaris CK, Spolaore F, Walker J, Whiston K, Willock D. Baletto F, et al. Among authors: miranda cr. Faraday Discuss. 2018 Sep 3;208(0):575-593. doi: 10.1039/c8fd90016g. Faraday Discuss. 2018. PMID: 30090887 No abstract available.
CO2 Adsorption Enhanced by Tuning the Layer Charge in a Clay Mineral.
Bø Hunvik KW, Loch P, Wallacher D, Kirch A, Cavalcanti LP, Rieß M, Daab M, Josvanger V, Grätz S, Yokaichiya F, Knudsen KD, Rodrigues Miranda C, Breu J, Fossum JO. Bø Hunvik KW, et al. Among authors: rodrigues miranda c. Langmuir. 2021 Dec 14;37(49):14491-14499. doi: 10.1021/acs.langmuir.1c02467. Epub 2021 Dec 1. Langmuir. 2021. PMID: 34851639 Free PMC article.
Theory as a driving force to understand reactions on nanoparticles: general discussion.
Arrigo R, Badmus K, Baletto F, Boeije M, Brinkert K, Bugaev A, Bukhtiyarov V, Carosso M, Catlow R, Chutia A, Davies P, de Leeuw N, Dononelli W, Freund HJ, Friend C, Gates B, Genest A, Hargreaves J, Hutchings G, Johnston R, Lamberti C, Marbaix J, Miranda CR, Odarchenko Y, Richards N, Russell A, Selvam P, Sermon P, Shah P, Shevlin S, Shozi M, Skylaris CK, Soulantica K, Torrente-Murciano L, Trunschke A, van Santen R, Verga LG, Whiston K, Willock D. Arrigo R, et al. Among authors: miranda cr. Faraday Discuss. 2018 Sep 3;208(0):147-185. doi: 10.1039/c8fd90013b. Faraday Discuss. 2018. PMID: 30094439 No abstract available.