TY  - BOOK
AU  - Lee June Gunn
TI  - Computational materials science: an introduction
SN  - 9781498749732 (hbk)
U1  - C211:(9S), Q7 
PY  - 2017///
CY  - Boca Raton 
PB  - CRC Press     
KW  -  Density functional theory
KW  -  MD exercises with XMD and LAMMPS
KW  -  Molecular dynamics
KW  - Chemistry
N1  - Appendix 319-341p.; Index343-351p
ER  -