Below you’ll find references to work developed within the scope of ComputEEL/MatSci. You can find other publications, from different collaborations, under each team member profile page, including links to academic content aggregators. Doi and full $Bib\TeX$ entries are provided so that you can easily cite us !
Ferreira, P.P., Conway, L.J., Cucciari, A., Di Cataldo, S., Giannessi, F., Kogler, E., Eleno, L.T.F., Pickard, C.J., Heil, C., & Boeri, L. (2023) Search for ambient superconductivity in the Lu-N-H system. Nat. Commun., 14, 1–10.
de Freitas, B.X., Dorini, T.T., Coelho, G.C., Nunes, C.A., & Eleno, L.T.F. (2019) Thermodynamic assessment of the RE–Zn (RE = Dy, Er, Ho, Tb) binaries as a starting step for a Mg–Zn–Zr–Rare earth multicomponent database. Calphad, 67, 101676.
Dorini, T.T. & Eleno, L.T.F. (2018) Thermodynamic reassessment of the Ni-In system using ab-initio data for end-member compound energies. Calphad, 62, 42–48.