Closed jtv3 closed 6 years ago
Fixed a problem in the function gvec_length which would manifest for large differences in the length of the 3 unit cell vectors (technically of the inverse)
Also fixed the optim function to give more optimal FFT grids
Fixed a problem in the function gvec_length which would manifest for large differences in the length of the 3 unit cell vectors (technically of the inverse)
Also fixed the optim function to give more optimal FFT grids