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-rw-r--r--homebrew/cp2k/.beer45
-rw-r--r--homebrew/cp2k/.make.sh-auto5
-rw-r--r--homebrew/cp2k/_metadata/description1
-rw-r--r--homebrew/cp2k/_metadata/homepage1
-rw-r--r--homebrew/cp2k/_metadata/name1
-rw-r--r--homebrew/cp2k/_metadata/version1
-rwxr-xr-xhomebrew/cp2k/download.sh1
7 files changed, 55 insertions, 0 deletions
diff --git a/homebrew/cp2k/.beer b/homebrew/cp2k/.beer
new file mode 100644
index 000000000..50caed5cd
--- /dev/null
+++ b/homebrew/cp2k/.beer
@@ -0,0 +1,45 @@
+{
+ "name": "Cp2k",
+ "description": "Quantum chemistry and solid state physics software package",
+ "url": "https://github.com/cp2k/cp2k/releases/download/v6.1.0/cp2k-6.1.tar.bz2",
+ "mirror": null,
+ "homepage": "https://www.cp2k.org/",
+ "depends": [
+ {
+ "depend": "fftw",
+ "build-depend": false
+ },
+ {
+ "depend": "gcc",
+ "build-depend": false
+ },
+ {
+ "depend": "libxc",
+ "build-depend": false
+ },
+ {
+ "depend": "open-mpi",
+ "build-depend": false
+ },
+ {
+ "depend": "scalapack",
+ "build-depend": false
+ }
+ ],
+ "resource": [
+ {
+ "name": "libint",
+ "url": "https://downloads.sourceforge.net/project/libint/v1-releases/libint-1.1.5.tar.gz"
+ }
+ ],
+ "conflicts": [],
+ "patches": [],
+ "install": [
+ "resource(\"libint\").stage do",
+ "system \"./configure\", \"--prefix=#{libexec}\"",
+ "system \"make\"",
+ "ENV.deparallelize { system \"make\", \"install\" }"
+ ],
+ "version": "6.1",
+ "file": "cp2k.rb"
+} \ No newline at end of file
diff --git a/homebrew/cp2k/.make.sh-auto b/homebrew/cp2k/.make.sh-auto
new file mode 100644
index 000000000..9c11a7bba
--- /dev/null
+++ b/homebrew/cp2k/.make.sh-auto
@@ -0,0 +1,5 @@
+pkg:setup
+resource("libint").stage do
+pkg:configure
+make
+ENV.deparallelize { system "make", "install" }
diff --git a/homebrew/cp2k/_metadata/description b/homebrew/cp2k/_metadata/description
new file mode 100644
index 000000000..9c6951e27
--- /dev/null
+++ b/homebrew/cp2k/_metadata/description
@@ -0,0 +1 @@
+Quantum chemistry and solid state physics software package
diff --git a/homebrew/cp2k/_metadata/homepage b/homebrew/cp2k/_metadata/homepage
new file mode 100644
index 000000000..6bcb7711d
--- /dev/null
+++ b/homebrew/cp2k/_metadata/homepage
@@ -0,0 +1 @@
+https://www.cp2k.org/
diff --git a/homebrew/cp2k/_metadata/name b/homebrew/cp2k/_metadata/name
new file mode 100644
index 000000000..faccc2afa
--- /dev/null
+++ b/homebrew/cp2k/_metadata/name
@@ -0,0 +1 @@
+Cp2k
diff --git a/homebrew/cp2k/_metadata/version b/homebrew/cp2k/_metadata/version
new file mode 100644
index 000000000..a435f5a56
--- /dev/null
+++ b/homebrew/cp2k/_metadata/version
@@ -0,0 +1 @@
+6.1
diff --git a/homebrew/cp2k/download.sh b/homebrew/cp2k/download.sh
new file mode 100755
index 000000000..d016a14f8
--- /dev/null
+++ b/homebrew/cp2k/download.sh
@@ -0,0 +1 @@
+wget https://github.com/cp2k/cp2k/releases/download/v6.1.0/cp2k-6.1.tar.bz2 \ No newline at end of file