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pyscf: new dependency bounds for pyscf, new version (#43300)

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liam-o-marsh 2024-03-25 16:24:01 +01:00 committed by GitHub
parent 303a0b3653
commit e5fdb90496
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1 changed files with 6 additions and 3 deletions
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var/spack/repos/builtin/packages/py-pyscf/package.py
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@ -12,12 +12,13 @@ class PyPyscf(PythonPackage):
by Python."""
homepage = "https://pyscf.org"
pypi = "pyscf/pyscf-2.2.0.tar.gz"
pypi = "pyscf/pyscf-2.5.0.tar.gz"
maintainers("naromero77")
license("Apache-2.0")
version("2.5.0", sha256="9596603c914fb3fba853607e96366fa541012faffd59a4ea052f0122dcea5343")
version("2.4.0", sha256="af0597c481851b5448e7055c3160aef28dc12a1e0b35dda8279555c0780c0d45")
version("2.3.0", sha256="71781de62c25924fd4e93ffeb0451ec0d0b3646fe426c75023f4f519f0f35d85")
version("2.2.1", sha256="4ff6851351caadc5dfa543b6b2c5fbd926ded87e3cc39faa0054e1e5090ed69a")
@ -37,8 +38,10 @@ class PyPyscf(PythonPackage):
depends_on("py-numpy@1.8.0:", type=("build", "run"))
depends_on("py-numpy@1.13.0:", type=("build", "run"), when="@2:")
conflicts("^py-numpy@1.16:1.17", when="@2:")
depends_on("py-scipy@0.12:", type=("build", "run"))
depends_on("py-scipy@0.19:", type=("build", "run"), when="@2.1:")
depends_on("py-scipy@0.12:1.10", type=("build", "run"), when="@:2.0")
depends_on("py-scipy@0.19:1.10", type=("build", "run"), when="@2.1:2.2")
# https://github.com/pyscf/pyscf/issues/1783
depends_on("py-scipy@0.19:", type=("build", "run"), when="@2.3:")
conflicts("^py-scipy@1.5.0:1.5.1", when="@2:")
depends_on("py-h5py@2.3.0:", type=("build", "run"))
depends_on("py-h5py@2.7.0:", type=("build", "run"), when="@2:")