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[ 原始碼: libxc ]
套件:libxc5(4.3.4-2)
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 libxc5 有關的套件
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- dep: libc6 (>= 2.14) [amd64]
- 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
- dep: libc6 (>= 2.17) [arm64, ppc64el]
- dep: libc6 (>= 2.7) [除 amd64, arm64, ppc64el]
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- dep: libgcc-s1 (>= 3.5) [armel, armhf]
- GCC 支援函式庫
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- dep: libgfortran5 (>= 8)
- Runtime library for GNU Fortran applications
下載 libxc5
硬體架構 | 套件大小 | 安裝後大小 | 檔案 |
---|---|---|---|
amd64 | 1,954。5 kB | 6,571。0 kB | [檔案列表] |
arm64 | 1,970。2 kB | 4,244。0 kB | [檔案列表] |
armel | 2,417。6 kB | 11,211。0 kB | [檔案列表] |
armhf | 2,074。5 kB | 5,479。0 kB | [檔案列表] |
i386 | 1,323。2 kB | 4,983。0 kB | [檔案列表] |
mips64el | 2,284。8 kB | 5,142。0 kB | [檔案列表] |
mipsel | 2,396。7 kB | 5,978。0 kB | [檔案列表] |
ppc64el | 2,232。8 kB | 4,888。0 kB | [檔案列表] |
s390x | 2,001。1 kB | 5,128。0 kB | [檔案列表] |