---
title: 环境要求
description: "硬件要求如表1所示。"
url: https://www.hikunpeng.com/document/detail/zh/kunpenghpcs/hpcindapp/prtg-osc/openmind_kunpengcp2k_02_0002.html
sourcePath: /source/zh/kunpenghpcs/hpcindapp/prtg-osc/openmind_kunpengcp2k_02_0002.html
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---
# 环境要求

#### 硬件要求

硬件要求如表1所示。


**表1 硬件要求**

| 项目 | 说明 |
| --- | --- |
| CPU | 鲲鹏920处理器 |


#### 软件要求

软件要求如表2所示。


**表2 软件要求**

| 项目 | 版本 | 下载地址 |
| --- | --- | --- |
| 毕昇编译器和Hyper MPI | 24.0.RC1 | https://www.hikunpeng.com/developer/hpc/hpckit\-download(https://www.hikunpeng.com/developer/hpc/hpckit\-download) |
| CP2K | 7.1 | https://github.com/cp2k/cp2k/releases/tag/v7.1.0(https://github.com/cp2k/cp2k/releases/tag/v7.1.0) |
| LIBINT | 2.6.0 | https://github.com/evaleev/libint/archive/(https://github.com/evaleev/libint/archive/v2.6.0.tar.gz) v2.6.0.tar.gz(https://github.com/evaleev/libint/archive/v2.6.0.tar.gz) |
| LIBXC | 4.3.4 | https://www.abinit.org/fallbacks(https://www.abinit.org/fallbacks) |
| FFTW | 3.3.8 | https://www.cp2k.org/static/downloads/(https://www.cp2k.org/static/downloads/) |
| LAPACK | 3.8.0 | https://www.cp2k.org/static/downloads/(https://www.cp2k.org/static/downloads/) |
| ScaLAPACK | 2.1.0 | https://www.cp2k.org/static/downloads/(https://www.cp2k.org/static/downloads/) |
| CMake | 3.16.4 | https://cmake.org/files/v3.16/(https://cmake.org/files/v3.16/cmake\-3.16.4.tar.gz) cmake\-3.16.4.tar.gz(https://cmake.org/files/v3.16/cmake\-3.16.4.tar.gz) |
| GMP | 6.2.0 | https://gmplib.org/download/gmp/(https://gmplib.org/download/gmp/gmp\-6.2.0.tar.xz) gmp\-6.2.0.tar.xz(https://gmplib.org/download/gmp/gmp\-6.2.0.tar.xz) |
| Boost | 1.72 | https://github.com/boostorg/boost/archive/refs/tags/boost\-1.72.0.tar.gz(https://github.com/boostorg/boost/archive/refs/tags/boost\-1.72.0.tar.gz) |
| DBCSR | 2.0.1 | https://github.com/cp2k/dbcsr/releases/(https://github.com/cp2k/dbcsr/releases/download/v2.0.1/dbcsr\-2.0.1.tar.gz) download/v2.0.1/dbcsr\-2.0.1.tar.gz(https://github.com/cp2k/dbcsr/releases/download/v2.0.1/dbcsr\-2.0.1.tar.gz) |
| ELPA | 2019.05.001 | https://www.cp2k.org/static/downloads/(https://www.cp2k.org/static/downloads/elpa\-2019.05.001.tar.gz) elpa\-2019.05.001.tar.gz(https://www.cp2k.org/static/downloads/elpa\-2019.05.001.tar.gz) |
| SPGLIB | 1.12.2 | https://github.com/spglib/spglib/archive/(https://github.com/spglib/spglib/archive/v1.11.2.1.tar.gz) v1.11.2.1.tar.gz(https://github.com/spglib/spglib/archive/v1.11.2.1.tar.gz) |
| GSL | 2.6 | http://mirrors.ustc.edu.cn/gnu/gsl/(http://mirrors.ustc.edu.cn/gnu/gsl/gsl\-2.6.tar.gz) gsl\-2.6.tar.gz(http://mirrors.ustc.edu.cn/gnu/gsl/gsl\-2.6.tar.gz) |
| PLUMED | 2.5.2 | https://www.cp2k.org/static/downloads/(https://www.cp2k.org/static/downloads/plumed\-2.5.2.tgz) plumed\-2.5.2.tgz(https://www.cp2k.org/static/downloads/plumed\-2.5.2.tgz) |
| OPENSSL | 1.1.1l | https://www.openssl.org/source/openssl\-1.1.1l.tar.gz(https://www.openssl.org/source/openssl\-1.1.1l.tar.gz) |
| 测试算例 | H2O\-256.inp | 软件自带测试算例：cp2k\-7.1.0/benchmarks/QS/。 |


#### 操作系统要求

操作系统要求如表3所示。


**表3 操作系统要求**

| 项目 | 版本 | 下载地址 |
| --- | --- | --- |
| openEuler | openEuler 21.03 | https://repo.openeuler.org/openEuler\-21.03/(https://repo.openeuler.org/openEuler\-21.03/) |
| Kernel | 4.14.0\-115 | 包含在操作系统镜像中。 |