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We are happy to assit you with problems. However, make sure that you check the following before emailing us.
- Complete all the tests in tests/ directory, make sure you can reproduce an output file ('out') that resembles very closely the expected output 'output_reference'. If not, then let us know and email us the out and output_reference
- Look in the tests/ directory for a simulation that is closer to the simulation that you want to setup. Then modify the input files accordningly
- If you get errors, send us the error messages, output (log) file, input files (control file, atom-atom-fiel, molecule-molecule-file) in *.zip or *.tar.gz format
Last edited by Shaji Chempath on: