Noura Dawass

4 S URFACE E FFECTS OF K IRKWOOD –B UFF I NTEGRALS FROM M OLECULAR S IMULATIONS ! = " + 1 " Surface term This chapter is based on the paper: N. Dawass, P. Krüger, S. K. Schnell, O. A. Moultos, I. G. Economou, T. J. H. Vlugt, and J. M. Simon, Kirkwood–Buff Integrals Using Molecular Simulation: Estimation of Surface Effects . Nanomaterials, 10 , 771 (2020) [128] 65