Prerequisites

If you want to download SHARC, please note that SHARC is only compatible with Linux systems. Windows and OS X are currently not supported.

You will need to have a Fortran 90 compiler, the libraries BLAS, LAPACK and FFTW3 and Python 2 installed on your system.

Quantum Chemistry Programs

The SHARC suite comes with an interface allowing to perform dynamics on analytical potentials. In order to carry out ab-initio (CASSCF) on-the-fly dynamics, you also need one of the following quantum chemistry programs:

If you have MOLCAS, you can also use COLUMBUS⇗ (at least 7.1, needs the COLUMBUS-MOLCAS interface) to carry out dynamics simulations on CASSCF and correlated multi-reference levels (MR-CISD, LRT-MRAQCC) of theory.

Additional Programs

For full functionality of the SHARC suite, several additional programs are recommended: