ABINIT Discussion Forums

Hi everyone, I tried to compile ABINIT 6.12.3 on linux opensuse 12.1 but I obtained errors for make install ./configure FC=ifort CC=icc INTEL 13 compilers Here is the error message: checking for NetCDF includes... -I/home/fab/prog/abinit-6.12.3/fallbacks/exports/include checking for NetCDF libraries...

Hi everybody,
Does anywone tried to compile ABINIT on CUDA-GPU ?
Which routines are GPU oriented ?
Thx

Fabien Fontaine-Vive
Institut de Chimie de Nice

Hi,
I would like to know if there is a keyword to specifiy the number of singlet or triplet TDDFT excitation energies since only at most 20 of them are printed
Thanks to the ABINIT community

Fabien Fontaine-Vive
Université de Nice