Publikationen von Matti Ropo

Ropo, M., V. Blum und C. Baldauf: Trends for isolated amino acids and dipeptides: Conformation, divalent ion binding, and remarkable similarity of binding to calcium and lead. Scientific Reports 6, 35772 (2016).

Ropo, M., M. Schneider, C. Baldauf und V. Blum: First-principles data set of 45,892 isolated and cation-coordinated conformers of 20 proteinogenic amino acids. Scientific Data 3, 160009 (2016).

Ihrig, A., J. Wieferink, I.Y. Zhang, M. Ropo, X. Ren, P. Rinke, M. Scheffler und V. Blum: Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory. New Journal of Physics 17 (9), 093020 (2015).

Pitkänen, H., M. Alatalo, A. Puisto, M. Ropo, K. Kokko und L. Vitos: Ab initio study of the surface properties of austenitic stainless steel alloys. Surface Science 609, 190–194 (2013).

Ropo, M., K. Kokko, E. Airiskallio, M.P.J. Punkkinen, S. Hogmark, J. Kollar, B. Johansson und L. Vitos: First-principles atomistic study of surfaces of Fe-rich Fe–Cr. Journal of Physics: Condensed Matter 23 (26), 265004 (2011).

Airiskallio , E., E. Nurmi , M.H. Heinonen , I.J. Väyrynen , K. Kokko , M. Ropo, M.P.J. Punkkinen , H. Pitkänen , M. Alatalo , J. Kollár , B. Johansson und L. Vitos : High temperature oxidation of Fe-Al and Fe-Cr-Al alloys: The role of Cr as a chemically active element. Corrosion Science 52 (10), 3394–3404 (2010).

Baldauf, C., M. Ropo, V. Blum und M. Scheffler: How mono-valent cations bend peptide turns and a first-principles database of amino acids and dipeptides. In: Proceedings of the International Conference of Computational Methods in Sciences and Engineering 2014: (ICCMSE 2014). (Hrsg.): T.E. Simos, Z. Kalogiratou, und T. Monovasilis. (AIP Conference Proceedings, Vol. 1618). AIP Publishing, Melville, NY, 119–120 (2014).