TABLE OF CONTENTS
::pwtk::rerunDAVIDSON
SYNOPSIS
proc ::pwtk::rerunDAVIDSON {args} {
USAGE
rerunDAVIDSON [options] input ?output?
PURPOSE
Re-run (restart) the turbo_davidson.x program. Prior to running, this routine will set the restart='restart'. The output-file will be treated in append mode, whereas the rest is the same as for the ::pwtk::runDAVIDSON routine.
OPTIONS
- -serial == run the calculation in serial mode (default = parallel)
- -prefix == explicitly specify the prefix for parallel execution
- -postfix == explicitly specify the postfix for parallel execution
- -exec == explicitly specify the turbo_davidson.x executable
- -ihandle <value> == explicitly set the input handle (for the description of input handle, see ::pwtk::input_handle)
ARGUMENTS
- input -- filename (or headname) to which the turbo_davidson.x input file will be stored. The .in (.out) suffix will be added to headname for input (output) filename.
- output -- [optional] filename to which the turbo_davidson.x output will be stored
SOURCE
input_pushpop { LR_INPUT { restart = 'restart' } eval {runDAVIDSON -append} $args } }