Search found 2 matches
- Sat Jun 01, 2019 8:28 am
- Forum: Response calculations
- Topic: Tutorial on optical properties [SOLVED]
- Replies: 1
- Views: 2919
Re: Tutorial on optical properties [SOLVED]
It is because abinit was not well compiled. netcdf is indispensable. ./configure --prefix=/public/app/abinit8.10.2 CC=mpicc CXX=mpicxx FC=mpif90 --with-atompaw-bins=/public/app/atompaw.4.1.0.5/bin --with-atompaw-libs="-L/public/app/atompaw.4.1.0.5/lib" --with-fft-flavor=fftw3 --with-fft-in...
- Sat May 25, 2019 3:43 am
- Forum: Response calculations
- Topic: Tutorial on optical properties [SOLVED]
- Replies: 1
- Views: 2919
Tutorial on optical properties [SOLVED]
Hi, I run abinit with this input file. When I set ndtset to 3, it went well. The log file is attached (1.out). Then I removed all the output files and set ndtset to 4, it terminated abnormally. The log file is attached (2.out). What is wrong with the fourth dataset?