Thu, 09 Jan 2025 15:38:51 UTC | login

Information for RPM CheMPS2-1.8.9-25.fc42.riscv64.rpm

ID1485268
NameCheMPS2
Version1.8.9
Release25.fc42
Epoch
Archriscv64
SummaryA spin-adapted implementation of DMRG for ab initio quantum chemistry
DescriptionThe CheMPS2 library provides a free open-source spin-adapted implementation of the density matrix renormalization group (DMRG) for ab initio quantum chemistry. This method allows to obtain numerical accuracy in active spaces beyond the capabilities of full configuration interaction. For the input Hamiltonian and targeted symmetry sector, the library performs successive DMRG sweeps according to a user-defined convergence scheme. As output, the library returns the minimal encountered energy as well as the 2-RDM of the active space. The latter allows to calculate various properties, as well as the gradient and Hessian for orbital rotations or nuclear displacements.
Build Time2025-01-04 09:42:21 GMT
Size565.72 KB
2010c8e9b984f177b5f62c34db2be034
LicenseGPL-2.0-or-later
Buildrootf42-build-864670-172514
Provides
CheMPS2 = 1.8.9-25.fc42
CheMPS2(riscv-64) = 1.8.9-25.fc42
libchemps2.so.3()(64bit)
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)
libc.so.6(GLIBC_2.33)(64bit)
libc.so.6(GLIBC_2.34)(64bit)
libc.so.6(GLIBC_2.38)(64bit)
libchemps2.so.3()(64bit)
libflexiblas.so.3()(64bit)
libgcc_s.so.1()(64bit)
libgcc_s.so.1(GCC_3.0)(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)
libhdf5.so.310()(64bit)
libm.so.6()(64bit)
libm.so.6(GLIBC_2.27)(64bit)
libstdc++.so.6()(64bit)
libstdc++.so.6(CXXABI_1.3)(64bit)
libstdc++.so.6(CXXABI_1.3.8)(64bit)
libstdc++.so.6(CXXABI_1.3.9)(64bit)
libstdc++.so.6(GLIBCXX_3.4)(64bit)
libstdc++.so.6(GLIBCXX_3.4.11)(64bit)
libstdc++.so.6(GLIBCXX_3.4.20)(64bit)
libstdc++.so.6(GLIBCXX_3.4.21)(64bit)
libstdc++.so.6(GLIBCXX_3.4.26)(64bit)
libstdc++.so.6(GLIBCXX_3.4.32)(64bit)
libstdc++.so.6(GLIBCXX_3.4.9)(64bit)
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
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
1 through 14 of 14
Name ascending sort Size
/usr/bin/chemps258.34 KB
/usr/lib/.build-id0.00 B
/usr/lib/.build-id/ba0.00 B
/usr/lib/.build-id/ba/d4181b3107eb1bd367bf8d4f4e4cb23207262a37.00 B
/usr/lib/.build-id/d80.00 B
/usr/lib/.build-id/d8/8d1b8abe081726040c0f2ab82c5b8adb65b0e227.00 B
/usr/lib64/libchemps2.so.31.08 MB
/usr/share/doc/CheMPS20.00 B
/usr/share/doc/CheMPS2/CHANGELOG.md3.44 KB
/usr/share/doc/CheMPS2/FILES.md22.50 KB
/usr/share/doc/CheMPS2/README.md4.86 KB
/usr/share/licenses/CheMPS20.00 B
/usr/share/licenses/CheMPS2/LICENSE17.67 KB
/usr/share/man/man1/chemps2.1.gz2.97 KB
Component of
1 through 2 of 2
Buildroot descending sort Created State
f42-build-864993-172672 2025-01-08 12:17:05 expired
f42-build-864803-172559 2025-01-04 17:35:43 expired