Molcas news #20: Molcas 7.4
************* MOLCAS News ****************
Molcas 7.4 is available. If you have a valid license for Molcas 7,
send a mail to molcas@teokem.lu.se to obtain the code.
New features in 7.4:
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New codes and major updates:
o There is a new set of coupled cluster codes added.
o The M06 DFT functional have been implemented.
o There are added constraints in slapaf.
o New method for transition state search and reaction coordinate analysis.
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New features in existing codes:
o There are improvements in the capabilities of the emil input.
o It is now possible to specify the actual name of the orbital
input files in modules SCF and GRID_IT.
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Changes in usage of the package:
o You can now get properties broken down by orbital contributions
by setting environment variable.
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Installation and tools
o You can now tell MOLCAS at configuration time to use an
externally installed version of Global Arrays.
o There are prebuilt versions of the GUI that can be installed in
a very simple manner.
o The default compiler on linux system is now gfortran.
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