Documentation for module cp2k_runs

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source: cp2k_runs.F
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public Subroutines/Functions:

runs the given input
writes a small html description of the cp2k input
SUBROUTINE
write_xml_file
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SUBROUTINErun_input(input_declaration, input_file_path, output_file_path, ierr, mpi_comm)

runs the given input

Arguments:
POINTER
:: input_declaration ...
CHARACTER(*),
INTENT(in)
:: input_file_path the path of the input file
CHARACTER(*),
INTENT(in)
:: output_file_path path of the output file (to which it is appended) if it is "__STD_OUT__" the default_output_unit is used
INTEGER,
INTENT(out)
:: ierr will return a number different from 0 if there was an error
INTEGER,
INTENT(in),
OPTIONAL
:: mpi_comm the mpi communicator to be used for this environment it will not be freed

SUBROUTINEwrite_cp2k_html_manual()

writes a small html description of the cp2k input

SUBROUTINEwrite_xml_file()

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