CASTEP can give information about total energies, forces and stresses on an atomic system, as well as calculating optimum geometries, band structures, optical spectra, phonon spectra and much more.
CASTEP can give information about total energies, forces and stresses on an atomic system, as well as calculating optimum geometries, band structures, optical spectra, phonon spectra and much more.
CASTEP能在一个原子系统上给全部的精力，力量和压力的信息，以及计算最佳几何学，乐队结构，光系列，声子系列并且更多。