Dear Wien2K community,
I am currently using the latest version of the WIEN2k
package (*Version:
WIEN2k_23.2*). At certain point of my work, I am in need of velocity term (
** ), where *nk* and *m*k are the indices of Bloch states. Here,
*n* & *m* denotes the band-indices and *k* stands
Dear all,
I cannot use the Vxc option LDA to calculate any struct(i have tried different
materials). Everything is fine when doing init, but there is an error in scf.
Program received signal SIGSEGV: Segmentation fault - invalid memory reference.
Backtrace for this error:
#0 0x7c1f5223960 in ??
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