TY  - GEN
AU  - Hirakawa,Teruo
AU  - Suzuki,Teppei
AU  - Bowler,David R
AU  - Miyazaki,Tsuyoshi
TI  - Canonical-ensemble extended Lagrangian Born-Oppenheimer molecular dynamics for the linear scaling density functional theory
SN  - 1361-648X
PY  - 2018///0208
N1  - Publication Type: Journal Article
UR  - https://doi.org/10.1088/1361-648X/aa810d
ER  -