Main /
InstallationTo install CFOUR, the following commands should be executed
The executables are then created directly from the source and are placed into the subdirectory bin (path/to/cfour/bin). The command (with the required permissions)
puts the executables in the directory /usr/local/cfour/bin. For further details concerning compilation and installation of CFOUR see the file INSTALL in the top-level directory of CFOUR. a) Fortran and C/C++ compilers are installed, b) a Blas libary is installed. ( If there is no blas libary follow this link ) Finally, for routine usage of CFOUR, it is necessary to include the location of the CFOUR executables (xcfour, xjoda, ...) in the path so that these modules can be directly invoked. The basis-set file GENBAS can be found in the directory path/to/cfour/basis (additional basis sets are easily downloaded in correct format from
EMSL (http://www.emsl.pnl.gov/forms/basisform.html), so far please use the ACESII Format). |