ABINIT Discussion Forums

Dear Users, Greetings When i use LDA+U, to calculate elastic constant, after running few minutes, I am getting the error like Please suggest. Best Regards Sanjeev - newkpt: read input wf with ikpt,npw= 2 6093, make ikpt,npw= 44 6093 - newkpt: read input wf with ikpt,npw= 12 6087, make ikpt,npw= 45 6...

Dear Sir Greetings I am relaxing alpha uranium structure using given below input file and i am getting the error: wfsinp: loop on k-points and spins done in parallel pareigocc : MPI_ALLREDUCE -P-0000 leave_test : synchronization done... wfsinp: loop on k-points done in parallel -P-0000 - newkpt: rea...