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cond-mat.mtrl-sci2019★ 88 cited
Direct comparison of many-body methods for realistic electronic Hamiltonians
Kiel T. Williams, Yuan Yao, Jia Li +22
A large collaboration carefully benchmarks 20 first principles many-body electronic structure methods on a test set of 7 transition metal atoms, and their ions and monoxides. Good…
cond-mat.mtrl-sci2016
Ultrafast Local Magnetization and Demagnetization in Heusler Alloys
P. Elliott, T. Müller, J. K. Dewhurst +2
With the goal of pushing Spintronic devices towards faster and faster timescales, we demonstrate, using ab-intio time-dependent density functional theory simulations of bulk Heusle…