Thermodynamically sick molecules: searching for defective experimental enthalpies of formation values using empirical and quantum chemistry methods

Santos, Rui C.; Almeida, Tânia S.; Agapito, Filipe; Rui M. Borges dos Santos; Martinho Simões, José A.; Prasad, R. B. N.; Custódio, Luísa; Malcata, F. Xavier; Varela, João; Barreira, Luísa

Rui Borges

Posição

Senior Researcher

Grau Académico

Doutoramento

Líder do Grupo

Marine Molecular Bioengineering

Categoria

Assistant

Localização

Faro, Gambelas Campus, UAlg

Gabinete

C8 3.8

Contacto

+351 289800985

Extensão

7985

rmsantos@ualg.pt

ORCID ID

Organiza

Eventos

Tipo de Evento

Evento Científico

Workshop: FROM MOLECULES TO CRYSTALS AND BEYOND

Este workshop reúne investigadores e estudantes (graduação, PhD) interessados em gênese de cristal, energética molecular e ciências marinhas no dia 4 de junho de 2019 | Auditório Verde | Edifício 8...

Grupo

Marine Molecular Bioengineering

Ter, 04/06/2019

Local

Green Auditorium | Building 8 | Gambelas Campus | University of Algarve

Tipo de Evento

Outros Eventos

ECOLOGICAL MUSIC - Call for reviewers

We want to use music to convey ecological concepts and foster environmental awareness. Together with musicians from the Mixed Music Lab, we’re preparing a concert called “Ecological Music”.

Seg, 11/11/2019

Local

ANFUP (wood pavillion) l Gambela Campus

Publicações

Year of Publication
2016	Gangadhar KN, Pereira H, Diogo HP, et al. Assessment and comparison of the properties of biodiesel synthesized from three different types of wet microalgal biomass. Journal of Applied Phycology. 2016;28(3):1571 - 1578. doi:10.1007/s10811-015-0683-5 Ler mais acerca de Assessment and comparison of the properties of biodiesel synthesized from three different types of wet microalgal biomass Google Scholar DOI
2015	Agapito F, Santos RC, Borges dos Santos RM, Simões JAMartinh. The Thermochemistry of Cubane 50 Years after Its Synthesis: A High-Level Theoretical Study of Cubane and Its Derivatives. The Journal of Physical Chemistry A. 2015;119(12):2998 - 3007. doi:10.1021/jp511756v Ler mais acerca de The Thermochemistry of Cubane 50 Years after Its Synthesis: A High-Level Theoretical Study of Cubane and Its Derivatives Google Scholar DOI
2013	Santos RC, Almeida TS, Agapito F, Borges dos Santos RM, Simões JAMartinh. Thermodynamically sick molecules: searching for defective experimental enthalpies of formation values using empirical and quantum chemistry methods. Structural Chemistry. 2013;24(6):2017 - 2026. doi:10.1007/s11224-013-0294-1 Ler mais acerca de Thermodynamically sick molecules: searching for defective experimental enthalpies of formation values using empirical and quantum chemistry methods Google Scholar DOI

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