Fri, 10 Jan 2025 09:38:40 UTC | login

Information for RPM psi4-1:1.9.1-4.fc42.src.rpm

ID1486339
Namepsi4
Version1.9.1
Release4.fc42
Epoch1
Archsrc
SummaryAn ab initio quantum chemistry package
DescriptionPSI4 is an open-source suite of ab initio quantum chemistry programs designed for efficient, high-accuracy simulations of a variety of molecular properties. We can routinely perform computations with more than 2500 basis functions running serially or in parallel.
Build Time2025-01-08 12:20:06 GMT
Size43.29 MB
28ecc49259a5e8849be6e7152d5b05d8
LicenseLGPL-3.0-only AND LicenseRef-Callaway-MIT
Buildrootf42-build-864993-172672
Provides
psi4 = 1:1.9.1-4.fc42
psi4-data = 1:1.9.1-4.fc42
Obsoletes No Obsoletes
Conflicts No Conflicts
Requires
CheMPS2-devel
bison-devel
boost-devel
byacc
cmake
dvipng
eigen3-devel
flex
flexiblas-devel
gau2grid-devel
gcc-c++
gcc-gfortran
gmp-devel
graphviz
gsl-devel
hdf5-devel
libecpint-devel
libefp-devel
libint2-devel >= 2.9.0-1
libxc-devel
mpfr-devel
perl-devel
pybind11-static
python3-deepdiff
python3-devel >= 2.7
python3-numpy
python3-optking
python3-pint
python3-pydantic
python3-pytest
python3-qcelemental
python3-qcengine
python3-scipy
python3-setuptools
python3-sphinx >= 1.1
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
tex(latex)
tex-preview
zlib-devel
Recommends No Recommends
Suggests No Suggests
Supplements No Supplements
Enhances No Enhances
Files
1 through 9 of 9
Name ascending sort Size
psi4-1.3.2-python3.patch604.00 B
psi4-1.9.1-libint2.patch1.21 KB
psi4-1.9.1-libxc7.patch1.36 KB
psi4-1.9.1-noecpgrad.patch676.00 B
psi4-1.9.1-noqcetest.patch991.00 B
psi4-1.9.1-nostrip.patch787.00 B
psi4-1.9.1-overflow.patch1.22 KB
psi4-1.9.1.tar.gz43.70 MB
psi4.spec15.98 KB
Component of No Buildroots