DFTtoolbox is based on numpy and matplotlib. Before installing DFTtoolbox, please make sure you have these package installed. Also, DFTtoolbox can only read the crystal structure and band high-symmytry path in xcrysden format (.xsf and .kpf). If you're not familar with xcrysden, check ...
Signal Processing toolbox, including DFT, IDFT, Wavelet, τp transform, HHT. Besides, this repository aslo has other useful functions, such as 1D/2D Convolution, Cross-Correlation, Filtering and Denosing. - EZ4BYG/Signal_Tools
MATLAB toolbox to read Siesta, a Density Functional Theory (DFT) calculation platform, generated files. Topics material-design dft simulation matlab density-functional-theory siesta Resources Readme License MIT license Activity Stars 0 stars Watchers 1 watching Forks 1 fork Report repository...