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Output files

STRUC_CONVERGE    contains the progress of the structural relaxation
STRUC_LOG         a detailed log about the relaxation steps performed
ELASTO_PHONON     information from the H matrix: Bulk modulus, phonon
frequencies
PW_LOG            a log about all the PW calls done
OUT               output file of the current plane wave job
CHECKPOINT        contains all the information to continue a
                  structural relaxation. Also has the Hessian matrix
*.dx              files for visualization with the IBM Data Explorer
*.kh              files for visualization with Khoros

Note: As of paratec 4.5c, the output file OUT._0 has been changed to OUT.



Jonathan Yates 2001-05-10