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vrijdag 24 februari 2017

Latest content from npj Computational Materials: 24 February 2017

Table of Contents: February 2017

Article | 23 February 2017

Effective mass and Fermi surface complexity factor from ab initio band structure calculations

Zachary M. Gibbs, Francesco Ricci, Guodong Li, Hong Zhu, Kristin Persson et al.

npj Comput Mater 3, Article number: s41524-017-0013-3 |  doi: 10.1038/s41524-017-0013-3

Article | 15 February 2017

Atomic structures of twin boundaries in hexagonal close-packed metallic crystals with particular focus on Mg

Zongrui Pei, Xie Zhang, Tilmann Hickel, Martin Friák, Stefanie Sandlöbes et al.

npj Comput Mater 3, Article number: s41524-017-0010-6 |  doi: 10.1038/s41524-017-0010-6

Article | 9 February 2017

Wide-range ideal 2D Rashba electron gas with large spin splitting in Bi2Se3/MoTe2 heterostructure

Te-Hsien Wang, Horng-Tay Jeng

npj Comput Mater 3, Article number: s41524-017-0011-5 |  doi: 10.1038/s41524-017-0011-5

Article | 3 February 2017

Comparison of dissimilarity measures for cluster analysis of X-ray diffraction data from combinatorial libraries

Yuma Iwasaki, A. Gilad Kusne, Ichiro Takeuchi

npj Comput Mater 3, Article number: s41524-017-0006-2 |  doi: 10.1038/s41524-017-0006-2

Review Article | 17 February 2017

Chemomechanical modeling of lithiation-induced failure in high-volume-change electrode materials for lithium ion batteries

Sulin Zhang

npj Comput Mater 3, Article number: s41524-017-0009-z |  doi: 10.1038/s41524-017-0009-z

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