From 0f44e42a706e8dcf00e8267519af72c37c843009 Mon Sep 17 00:00:00 2001 From: "Paul R. C. Kent" Date: Fri, 16 May 2025 01:08:55 -0400 Subject: [PATCH] py-pyscf: add v2.9.0 (#50350) * py-pyscf: add v2.9.0 * Remove cmake 4 conflict * require setuptools 61.0+ --- .../repos/spack_repo/builtin/packages/py_pyscf/package.py | 5 ++++- 1 file changed, 4 insertions(+), 1 deletion(-) diff --git a/var/spack/repos/spack_repo/builtin/packages/py_pyscf/package.py b/var/spack/repos/spack_repo/builtin/packages/py_pyscf/package.py index dd245c0591e..9a0311b412d 100644 --- a/var/spack/repos/spack_repo/builtin/packages/py_pyscf/package.py +++ b/var/spack/repos/spack_repo/builtin/packages/py_pyscf/package.py @@ -17,6 +17,7 @@ class PyPyscf(PythonPackage): license("Apache-2.0") + version("2.9.0", sha256="821dc882f3a5485d8f202abb093330cf1497b26767ba2a1a63b7fa600ddc58a3") version("2.8.0", sha256="db720372e7f7d1aa2df0fb90c07f483da363730197c937a6378952d34b6abf3d") version("2.7.0", sha256="ca8efc2f28d72c3130f26a967e7fa8d0bbc4a6b47d16a7c4c732ec85a31b7eec") version("2.6.2", sha256="744c89a8e4d38c4b5562f75fa68f9d079faeb23602d255fba0eb6d1bac97bca2") @@ -33,7 +34,8 @@ class PyPyscf(PythonPackage): version("1.7.5", sha256="52856b39f0ada2f6340757caa65dc5c1d9a3cdfceea2a6615ad8af92664a6c69") version("1.7.3", sha256="62a26146a222140395b276ea33182f87809a21989ddcf78e2dcb8e35ebc57af2") - depends_on("c", type="build") # generated + depends_on("c", type="build") + depends_on("cxx", type="build") # dependencies depends_on("cmake@3.10:", type="build", when="@2.1:") @@ -41,6 +43,7 @@ class PyPyscf(PythonPackage): depends_on("python@3.6:", type=("build", "run"), when="@2.1:") depends_on("python@2.6:", type=("build", "run")) depends_on("py-setuptools", type="build") + depends_on("py-setuptools@61.0:", type="build", when="@2.9.0:") depends_on("py-numpy@1.8.0:", type=("build", "run")) depends_on("py-numpy@1.13.0:", type=("build", "run"), when="@2:") depends_on("py-numpy@1", type=("build", "run"), when="@:2.6.0")