A..2.2.3 Ubuntu packages

To build using GNU compilers one should ensure the following packages are installed via (apt-get):
build-essential
provides GNU C++ compiler,
curl
provides curl for downloading patches,
gfortran
provides GNU Fortran compiler,
libxml2-dev
provides libxml2 library & headers,
openssh-server
provides ssh access to localhost.
Optionally one can choose to install:
libblas-dev
provides a BLAS library,
liblapack-dev
provides a LAPACK library,
which will be used instead of compiling the equivalent MOLPRO routines. Set up password-less ssh by running the following commands and not entering a password when prompted:
ssh-keygen -t rsa
cat ~/.ssh/id_rsa.pub >> ~/.ssh/authorized_keys
This must be done for each user account which will be running MOLPRO.



molpro@molpro.net 2018-12-16