*/*: bump PORTREVISION after the upgrade of MPICH to 4.1.2

*: Bump PORTREVISIONs for math/mpc update to 1.3.1

science/libgridxc: Update 0.9.6 -> 1.1.0; Add options for MPI choices

Change to cmake.

PR:		267078
Submitted by:	diizzy@ (previous version)

Remove WWW entries moved into port Makefiles

Commit b7f05445c00f has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.

This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.

Approved by:		portmgr (tcberner)

Add WWW entries to port Makefiles

It has been common practice to have one or more URLs at the end of the
ports' pkg-descr files, one per line and prefixed with "WWW:". These
URLs should point at a project website or other relevant resources.

Access to these URLs required processing of the pkg-descr files, and
they have often become stale over time. If more than one such URL was
present in a pkg-descr file, only the first one was tarnsfered into
the port INDEX, but for many ports only the last line did contain the
port specific URL to further information.

There have been several proposals to make a project URL available as
a macro in the ports' Makefiles, over time.

science/libgridxc: Update 0.8.5 -> 0.9.6

Project moved to GitLab.

One more small cleanup, forgotten yesterday.
Reported by:	lwhsu

Remove # $FreeBSD$ from Makefiles.

Fix r561520

/!\ libgridxc-0.8.5_3: Makefile errors /!\

you cannot include bsd.port[.pre].mk twice

Defining both PORTVERSION and DISTVERSION is wrong, only set one, if necessary,
set DISTNAME

*** Error code 1

Stop.
make: stopped in /usr/ports/science/libgridxc

Approved by:	portmgr (blanket)

Update GCC_DEFAULT from 9 to 10.

A few (mostly Fortran-based) ports need to be patched because GCC 10
is stricter.  A handful of ports need to be restricted to GCC 9 because
they fail with 10.

5 ports still fail with GCC 10.  However, seeing as this work has been
ongoing since 2020-05-24, it is simply time to make the commit and
notify the affected maintainers.

While here, pet portlint (Makevar order).

PR:		246700
Submitted by:	gerald
Approved by:	antoine (after many, many, -exp runs)

science/libgridxc: Unbreak build by disabling the option that breaks

MFH:		2020Q4

Mark BROKEN

mpif90 -c -O2 -fPIC  -fimplicit-none -I /usr/local/include  -I./MPI_instr
-I./MPI_instr -I./MPI_instr  -DMPI -DLIBXC
/wrkdirs/usr/ports/science/libgridxc/work/libgridxc-0.8.5/src/ldaxc.F90
/wrkdirs/usr/ports/science/libgridxc/work/libgridxc-0.8.5/src/ldaxc.F90:98:8:

   98 |     use xc_f90_types_m
      |        1
Fatal Error: Cannot open module file 'xc_f90_types_m.mod' for reading at (1): No
such file or directory

Reported by:	pkg-fallout

Bump PORTREVISION for ports depending on the canonical version of GCC
as defined in Mk/bsd.default-versions.mk which has moved from GCC 8.3
to GCC 9.1 under most circumstances now after revision 507371.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, everything INDEX-11 shows with a dependency on lang/gcc9 now.

PR:		238330

Related to revision 499061 bump ports with USES=fortran to have them
benefit from the improved situation where libgcc_s is only used when
absolutely necessary.

Suggested by:	tijl

science/libgridxc: Update 0.8.4 -> 0.8.5

Reported by:	portscout

Bump PORTREVISION for ports depending on the canonical version of GCC
defined via Mk/bsd.default-versions.mk which has moved from GCC 7.4 t
GCC 8.2 under most circumstances.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, as a double check, everything INDEX-11 showed depending on lang/gcc7.

PR:		231590

science/libgridxc: Update 0.8.3 -> 0.8.4

Reported by:	portscout

science/libgridxc: Update 0.8.0 -> 0.8.3

Reported by:	portscout

science/libxc: Update 3.0.0 -> 4.2.3

PR:		231648
Approved by:	dieterich@ogolem.org (maintainer's timeout; 27 days)

Change 20 ports from net/mpich2 to net/mpich

mpich2 is the obsolete version 2.x, mpich is at the current version 3.x

Ports:
math/scalapack science/nwchem science/quantum-espresso science/qmcpack
science/madness
science/qbox science/openmx science/jdftx science/fleur science/libgridxc
science/mdynamix science/lm science/dftbplus science/py-gpaw devel/ga
math/elpa net/charm science/gromacs math/pari math/arpack-ng-mpich

New port: science/libgridxc: Library to compute the exchange and correlation
energy and potentials