# N2 system. 
# Excited state computation, using LDA/TDLDA
# Uses nsppol=2, although the molecule is not spin-polarized

 ndtset  2  

#DATASET 1  SCF
   nband1   5
  prtden1   1
  getden1   0
  getwfk1   0
  tolwfr1   1.0d-15

#DATASET 2 TDDFT
#Common to all except GS calculations
  nband2    12
 getden2    1
 getwfk2    1
 tolwfr2    1.0d-9
   iscf2   -1

#Common
 acell 6  5  5.001 Angstrom
 nsppol 2   spinmagntarget 0.0d0
 boxcenter 3*0.0d0
 diemac 1.0d0   diemix 0.5d0
 ecut 25
 ixc  1
 paral_kgb 0
 kptopt 0
 natom  2 
 nbdbuf 0

 nstep 25
 ntypat  1
 typat  1 1
 xcart -0.54885  0 0  0.54885 0 0 Angstrom   ! Distance 1.0977 Angstrom
 znucl  7


 pp_dirpath "$ABI_PSPDIR"
 pseudos "PseudosHGH_pwteter/7n.5.hgh"

#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% [files]
#%% [paral_info]
#%% nprocs_to_test = 1, 2, 4, 10
#%% max_nprocs = 10
#%% [NCPU_1]
#%% files_to_test = t05_MPI1.out, tolnlines=   0,   tolabs=  0.0,      tolrel= 0.0
#%% [NCPU_2]
#%% files_to_test = t05_MPI2.out, tolnlines=   0,   tolabs=  0.0,      tolrel= 0.0
#%% [NCPU_4]
#%% files_to_test = t05_MPI4.out, tolnlines=   0,   tolabs=  0.0,      tolrel= 0.0
#%% [NCPU_10]
#%% files_to_test = t05_MPI10.out, tolnlines=   0,   tolabs=  0.0,      tolrel= 0.0
#%% [extra_info]
#%% keywords = NC, TDDFT
#%% authors = Unknown
#%% description = 
#%%   N2 molecule
#%%   Test TDDFT in parallel, with nsppol=2 even if the molecule is non spin-polarized
#%% topics = TDDFT
#%%<END TEST_INFO>