Tue, 05 Nov 2024 00:01:47 UTC | login

Information for RPM python3-pyscf-2.6.0-5.fc41.riscv64.rpm

ID1370211
Namepython3-pyscf
Version2.6.0
Release5.fc41
Epoch
Archriscv64
SummaryPython 3 module for quantum chemistry
DescriptionPython‐based simulations of chemistry framework (PySCF) is a general‐purpose electronic structure platform designed from the ground up to emphasize code simplicity, so as to facilitate new method development and enable flexible computational workflows. The package provides a wide range of tools to support simulations of finite‐size systems, extended systems with periodic boundary conditions, low‐dimensional periodic systems, and custom Hamiltonians, using mean‐field and post‐mean‐field methods with standard Gaussian basis functions. To ensure ease of extensibility, PySCF uses the Python language to implement almost all of its features, while computationally critical paths are implemented with heavily optimized C routines. Using this combined Python/C implementation, the package is as efficient as the best existing C or Fortran‐based quantum chemistry programs.
Build Time2024-07-26 14:51:35 GMT
Size11.49 MB
f20276684858d801fc8f3e83d5a6606a
LicenseASL 2.0
Buildrootf41-build-822549-153120
Provides
python-pyscf = 2.6.0-5.fc41
python3-pyscf = 2.6.0-5.fc41
python3-pyscf(riscv-64) = 2.6.0-5.fc41
python3.13-pyscf = 2.6.0-5.fc41
Obsoletes No Obsoletes
Conflicts No Conflicts
Requires
ld-linux-riscv64-lp64d.so.1()(64bit)
ld-linux-riscv64-lp64d.so.1(GLIBC_2.27)(64bit)
libc.so.6()(64bit)
libc.so.6(GLIBC_2.27)(64bit)
libcint.so.5()(64bit)
libflexiblas.so.3()(64bit)
libgcc_s.so.1()(64bit)
libgcc_s.so.1(GCC_3.3.1)(64bit)
libgomp.so.1()(64bit)
libgomp.so.1(GOMP_1.0)(64bit)
libgomp.so.1(GOMP_4.0)(64bit)
libgomp.so.1(GOMP_4.5)(64bit)
libgomp.so.1(OMP_1.0)(64bit)
libxc.so.12()(64bit)
libxcfun.so.2()(64bit)
python(abi) = 3.13
python3-h5py
python3-numpy
python3-scipy
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
rpmlib(PartialHardlinkSets) <= 4.0.4-1
rpmlib(PayloadFilesHavePrefix) <= 4.0-1
rpmlib(PayloadIsZstd) <= 5.4.18-1
rtld(GNU_HASH)
Recommends No Recommends
Suggests No Suggests
Supplements No Supplements
Enhances No Enhances
Files
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/usr/lib64/python3.13/site-packages/pyscf0.00 B
/usr/lib64/python3.13/site-packages/pyscf/__all__.py799.00 B
/usr/lib64/python3.13/site-packages/pyscf/__config__.py1011.00 B
/usr/lib64/python3.13/site-packages/pyscf/__init__.py4.52 KB
/usr/lib64/python3.13/site-packages/pyscf/__pycache__0.00 B
/usr/lib64/python3.13/site-packages/pyscf/__pycache__/__all__.cpython-313.opt-1.pyc604.00 B
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/usr/lib64/python3.13/site-packages/pyscf/__pycache__/__config__.cpython-313.pyc1.46 KB
/usr/lib64/python3.13/site-packages/pyscf/__pycache__/__init__.cpython-313.opt-1.pyc4.14 KB
/usr/lib64/python3.13/site-packages/pyscf/__pycache__/__init__.cpython-313.pyc4.14 KB
/usr/lib64/python3.13/site-packages/pyscf/__pycache__/post_scf.cpython-313.opt-1.pyc357.00 B
/usr/lib64/python3.13/site-packages/pyscf/__pycache__/post_scf.cpython-313.pyc357.00 B
/usr/lib64/python3.13/site-packages/pyscf/adc0.00 B
/usr/lib64/python3.13/site-packages/pyscf/adc/__init__.py2.55 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__0.00 B
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/__init__.cpython-313.opt-1.pyc2.25 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/__init__.cpython-313.pyc2.25 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/dfadc.cpython-313.opt-1.pyc5.69 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/dfadc.cpython-313.pyc5.69 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/radc.cpython-313.opt-1.pyc20.64 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/radc.cpython-313.pyc20.82 KB
/usr/lib64/python3.13/site-packages/pyscf/adc/__pycache__/radc_amplitudes.cpython-313.opt-1.pyc36.00 KB
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