[ 原始碼: libxc ]
套件:libxc9(5.2.3-1)
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.
其他與 libxc9 有關的套件
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- dep: libc6 (>= 2.29)
- GNU C 函式庫:共用函式庫
同時作為一個虛擬套件由這些套件填實: libc6-udeb
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- dep: libgcc-s1 (>= 3.5) [armel, armhf]
- GCC 支援函式庫
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- dep: libgfortran5 (>= 10)
- Runtime library for GNU Fortran applications
下載 libxc9
硬體架構 | 套件大小 | 安裝後大小 | 檔案 |
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amd64 | 3,739。1 kB | 11,876。0 kB | [檔案列表] |
arm64 | 3,486。0 kB | 7,839。0 kB | [檔案列表] |
armel | 4,479。5 kB | 19,275。0 kB | [檔案列表] |
armhf | 3,393。8 kB | 9,035。0 kB | [檔案列表] |
i386 | 2,471。9 kB | 9,217。0 kB | [檔案列表] |
mips64el | 4,008。1 kB | 8,902。0 kB | [檔案列表] |
mipsel | 3,994。0 kB | 9,840。0 kB | [檔案列表] |
ppc64el | 3,792。3 kB | 8,159。0 kB | [檔案列表] |
s390x | 3,407。2 kB | 8,558。0 kB | [檔案列表] |