Calculation of the lattice constant of solids with semilocal functionals (vol 79, 085104, 2009)

PHYSICAL REVIEW B

卷 79, 期 20, 页码 -

AMER PHYSICAL SOC

Brillouin zones; Fourier transforms; integration; lattice constants; linear muffin-tin orbital method

Materials Science, Multidisciplinary Physics, Applied Physics, Condensed Matter