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Contents

No Journal_name Subject Date DOI Author
800758 COMPUTATIONAL MATERIALS SCIENCE Forward to the rising stars virtual special issue of computational materials science 2022-02-01 10.1016/j.commatsci.2021.111086 Sinnott Susan B.
800757 COMPUTATIONAL MATERIALS SCIENCE Development of a plasticity-oriented interatomic potential for CrFeMnNi high entropy alloys 2022-02-01 10.1016/j.commatsci.2021.111165 Daramola Ayobami, Bonny Giovanni, Adjanor Gilles, Domain Christophe, Monnet Ghiath, Fraczkiewicz Anna
800756 COMPUTATIONAL MATERIALS SCIENCE Scalable morphological accessibility of complex microstructures 2022-02-01 10.1016/j.commatsci.2021.111062 Chaniot Johan, Moreaud Maxime, Sorbier Loïc, Becker Jean-Marie, Fournel Thierry
800755 COMPUTATIONAL MATERIALS SCIENCE Interatomic Fe–Cr potential for modeling kinetics on Fe surfaces 2022-02-01 10.1016/j.commatsci.2021.110840 Kuopanportti Pekko, Ropo Matti, Holmberg Daniel, Levämäki Henrik, Kokko Kalevi, Granroth Sari, Kuronen Antti
800754 COMPUTATIONAL MATERIALS SCIENCE Atomistic simulation of martensite microstructural evolution during temperature driven β→α transition in pure titanium 2022-02-01 10.1016/j.commatsci.2021.111057 Baruffi C., Finel A., Le Bouar Y., Bacroix B., Salman O.U.
800753 COMPUTATIONAL MATERIALS SCIENCE Effect of substitutional Ni atoms on the Snoek relaxation in ferrite and martensite Fe-C alloys: An atomisitic investigation 2022-02-01 10.1016/j.commatsci.2021.111083 Huang Liangzhao, Maugis Philippe
800752 COMPUTATIONAL MATERIALS SCIENCE The impact of anionic vacancies on the mechanical properties of NbC and NbN: An ab initio study 2022-02-01 10.1016/j.commatsci.2021.111113 Muchiri P.W., Korir K.K., Makau N.W., Amolo G.O.
800751 COMPUTATIONAL MATERIALS SCIENCE Defects, dopants and lithium incorporation in LiPON electrolyte 2022-02-01 10.1016/j.commatsci.2021.111000 Kuganathan Navaratnarajah, Chroneos Alexander
800750 COMPUTATIONAL MATERIALS SCIENCE Anisotropy in interface stress at the bcc-iron solid–melt interface: Molecular dynamics and phase field crystal modelling 2022-02-01 10.1016/j.commatsci.2021.110982 Kumar Sushil, Liu Ming-Wei, Wu Kuo-An, Gururajan M.P.
800749 COMPUTATIONAL MATERIALS SCIENCE Retraction notice to “Modeling charpy impact energy of functionallygraded steel based on the strain gradient plasticity theory and modified stress–strain curve data” Comput. Mater. Sci. 50/12 (pages 3350–3357) 2022-02-01 10.1016/j.commatsci.2021.111017 Nazari Ali