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Information for RPM CheMPS2-1.8.9-1.fc29.riscv64.rpm

ID269174
NameCheMPS2
Version1.8.9
Release1.fc29
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 Time2018-11-23 10:07:13 GMT
Size460.99 KB
1c9bd6557ccac9e3e8a74e6db4b7680c
LicenseGPLv2+
Buildrootf29-build-32834-17264
Provides
CheMPS2 = 1.8.9-1.fc29
CheMPS2(riscv-64) = 1.8.9-1.fc29
libchemps2.so.3()(64bit)
Obsoletes No Obsoletes
Conflicts No Conflicts
Requires
/sbin/ldconfig
/sbin/ldconfig
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)
libchemps2.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(OMP_1.0)(64bit)
libhdf5.so.10()(64bit)
libm.so.6()(64bit)
libm.so.6(GLIBC_2.27)(64bit)
libopenblaso.so.0()(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_3.4.9)(64bit)
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
rpmlib(PayloadFilesHavePrefix) <= 4.0-1
rpmlib(PayloadIsXz) <= 5.2-1
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/chemps260.31 KB
/usr/lib/.build-id0.00 B
/usr/lib/.build-id/030.00 B
/usr/lib/.build-id/03/b69f0b4ea7c5f5d949c4348578d9a7c49000b737.00 B
/usr/lib/.build-id/e30.00 B
/usr/lib/.build-id/e3/9046b12e19c287ab13d168a3a0bbe1199d067627.00 B
/usr/lib64/libchemps2.so.3919.46 KB
/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 No Buildroots