<pre style='margin:0'>
David Strubbe (dstrubbe) pushed a commit to branch master
in repository macports-ports.

</pre>
<p><a href="https://github.com/macports/macports-ports/commit/459afd3364866ce27c69e5abce4fb8dfad35809b">https://github.com/macports/macports-ports/commit/459afd3364866ce27c69e5abce4fb8dfad35809b</a></p>
<pre style="white-space: pre; background: #F8F8F8">The following commit(s) were added to refs/heads/master by this push:
<span style='display:block; white-space:pre;color:#404040;'>     new 459afd3  quantum-espresso: Update to version 6.1.
</span>459afd3 is described below

<span style='display:block; white-space:pre;color:#808000;'>commit 459afd3364866ce27c69e5abce4fb8dfad35809b
</span>Author: David Strubbe <dstrubbe@macports.org>
AuthorDate: Wed Jul 5 15:46:11 2017 -0700

<span style='display:block; white-space:pre;color:#404040;'>    quantum-espresso: Update to version 6.1.
</span><span style='display:block; white-space:pre;color:#404040;'>    
</span><span style='display:block; white-space:pre;color:#404040;'>    Add running PP examples in test and revise comments on test results.
</span>---
 science/quantum-espresso/Portfile | 26 +++++++++++++++-----------
 1 file changed, 15 insertions(+), 11 deletions(-)

<span style='display:block; white-space:pre;color:#808080;'>diff --git a/science/quantum-espresso/Portfile b/science/quantum-espresso/Portfile
</span><span style='display:block; white-space:pre;color:#808080;'>index ba888b4..37e5fa9 100644
</span><span style='display:block; white-space:pre;background:#e0e0ff;'>--- a/science/quantum-espresso/Portfile
</span><span style='display:block; white-space:pre;background:#e0e0ff;'>+++ b/science/quantum-espresso/Portfile
</span><span style='display:block; white-space:pre;background:#e0e0e0;'>@@ -5,7 +5,7 @@ PortGroup           mpi 1.0
</span> PortGroup           linear_algebra 1.0
 
 name                quantum-espresso
<span style='display:block; white-space:pre;background:#ffe0e0;'>-version             6.0
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+version             6.1
</span> categories          science
 platforms           darwin
 license             GPL-2
<span style='display:block; white-space:pre;background:#e0e0e0;'>@@ -21,16 +21,16 @@ long_description    An integrated suite of open-source computer codes for electr
</span> 
 homepage            http://www.quantum-espresso.org
 # get link from http://www.qe-forge.org/gf/project/q-e/frs/?action=FrsReleaseBrowse&frs_package_id=18
<span style='display:block; white-space:pre;background:#ffe0e0;'>-set url http://www.qe-forge.org/gf/download/frsrelease/224
</span><span style='display:block; white-space:pre;background:#ffe0e0;'>-master_sites        ${url}/1044:espresso ${url}/1043:examples
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+set url http://www.qe-forge.org/gf/download/frsrelease/240
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+master_sites        ${url}/1075:espresso ${url}/1072:examples
</span> distfiles           qe-${version}${extract.suffix}:espresso \
                     qe-${version}-examples${extract.suffix}:examples
 checksums           qe-${version}${extract.suffix} \
<span style='display:block; white-space:pre;background:#ffe0e0;'>-    rmd160  5e0246fc8e71472783de7a25cac507e2842c147b \
</span><span style='display:block; white-space:pre;background:#ffe0e0;'>-    sha256  2481d9291e4f85652af204c1b702caee8900a644fb62c8a510a8127e8571ba9d \
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    rmd160  0565aac0e2f0fa432229d382da9cbc815fada386 \
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    sha256  4c19c8076b95d01ac298982cfc3e1b5f60611fb6cf4175689aef2f350c5e23bf \
</span>     qe-${version}-examples${extract.suffix} \
<span style='display:block; white-space:pre;background:#ffe0e0;'>-    rmd160  c9fad14013d20dfeec88d9e0e6bf8bd4682d73e2 \
</span><span style='display:block; white-space:pre;background:#ffe0e0;'>-    sha256  8f5e6b40fe5fedcbc45b9e039ba5d4fc0d0d51c5d0f81033376c33683f01fdbf
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    rmd160  1536f226e09a207fb599f5afcb4a87051f76d14e \
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    sha256  0374748374e807e81b1b24379e9a1860e556e50f33c4181d4b3fa1fa1f092ed6
</span> 
 depends_lib-append  port:fftw-3
 
<span style='display:block; white-space:pre;background:#e0e0e0;'>@@ -79,11 +79,15 @@ test {
</span>     # some PHonon tests will use gnuplot if available
     ui_msg "Running PHonon examples"
     system -W ${worksrcpath}/Examples/PHonon "./run_all_examples"
<span style='display:block; white-space:pre;background:#ffe0e0;'>-    ui_msg "Inspect logfile to see if tests passed."
</span><span style='display:block; white-space:pre;background:#ffe0e0;'>-}
</span> 
<span style='display:block; white-space:pre;background:#ffe0e0;'>-# error has been found to occur for Examples/PW/vdWDF
</span><span style='display:block; white-space:pre;background:#ffe0e0;'>-# :info:test   running the graphite cell relaxation...application called MPI_Abort(MPI_COMM_WORLD, 1) - process 3
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    # WAN90_example will not run since wannier90.x (from Wannier90 port) would be needed.
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    # example02 was found to fail in parallel with MPI_Bcast error
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    ui_msg "Running PP examples"
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    system -W ${worksrcpath}/Examples/PP "./run_all_examples"
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    # add examples for atomic
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+    ui_msg "Inspect logfile (and results directories) to see if tests passed."
</span><span style='display:block; white-space:pre;background:#e0ffe0;'>+}
</span> 
 configure.args-append   --prefix=${destroot}${prefix} --with-scalapack=no
 
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