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CFOUR | Main Configure Configure `configure' configures CFOUR to adapt to many kinds of systems Usage: configure [OPTION] [VAR=VALUE] To assign environment variables (e g , CC, CFLAGS ), specify them as VAR=VALUE See below for descriptions of some of the useful variables Defaults for the options are specified in brackets Configuration:
CFOUR | Main Quantum Chemical Methods Comp 12, 4284-4295 (2016); implementation in CFourT Nottoli, F Lipparini and J Gauss, Second-Order CASSCF Algorithm with the Cholesky Decomposition of the Two-Electron Integrals, J Chem Theor Comp 17, 6819-6831 (2021); implementation in CFour using Cholesky decomposition convergence acceleration in SCF (DIIS)
CFOUR | Main Git Lab Obtaining the Source Code from the GitLab Server Registered users may use the following steps to access the up-to-date CFOUR public source code: