Package: libxc9 (5.2.3-1 and others) [debports]
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- Homepage [www.tddft.org]
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Library of Exchange-Correlation Functionals
LibXC is a library of exchange-correlation (XC) functionals for density-functional theory (DFT). The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals that can be used by other codes. Supported XC functionals include:
* Local Density Approximation (LDA) functionals including Slater exchange, and VWN, Perdew-Zunger or PADE correlation. * Generalized Gradient Approximation (GGA) XC functionals including PBE, PW91, BLYP, HCTH93, HCTH120, HCTH147, HCTH407, as well as B88 exchange and LYP or P86 correlation. * Hybrid XC functionals including B3LYP, PBE0, B97, X3LYP, BHANDH, HSE03 and HSE06. * Meta-GGA XC functionals including TPSS, M05 and M06.
Other Packages Related to libxc9
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- dep: libc6 (>= 2.29)
- GNU C könyvtár: megosztott könyvtárak
also a virtual package provided by libc6-udeb
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- dep: libgfortran5 (>= 10)
- Runtime library for GNU Fortran applications
Download libxc9
Architecture | Version | Package Size | Installed Size | Files |
---|---|---|---|---|
ppc64 (unofficial port) | 5.2.3-1+b1 | 3,655.0 kB | 8,548.0 kB | [list of files] |