Orca 4.1.2 manual

とp フォーラム gし3 Orca 4.1.2 manual

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    ORCA can run in multiple processors with the aid of OpenMPI (the recommended version for ORCA 5 is 4.1.1). After installing it and setting the PATH andWelcome to the ORCA Forum. ORCA 5.0.3 has been released! Latest bugfix release in the ORCA 5.0.x series. For more information, please enter the forum. Menu.
    The ORCA Input Library contains a collection of ORCA input that show you how to easily do various tasks using the many methods and approximations in the ORCA
    With the release of ORCA 4.1, they have moved our forum and download site to a new server at the Max Plan.
    ORCA . ** This manual is work in progress, please check regularly for updates ** There are currently several version of ORCA available on HPC: 4.1.2,
    ORCA. – An ab initio, DFT and semiempirical SCF-MO package – installation instructions aside from the manual is the ORCA input library.

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