tar -xf Gaussian16/G16-A03-AVX2.tbz -C /opt/biosoft/
cd /opt/biosoft/g16/
export g16root=/opt/biosoft
mkdir /opt/biosoft/g16/scratch
export GAUSS_SCRDIR=/opt/biosoft/g16/scratch/
source /opt/biosoft/g16/bsd/g16.profile
vim /opt/biosoft/g16/Default.Route
-M- 30GB
-P- 16
./bsd/install #必须在g16路径下如:/opt/biosoft/g16
chmod 750 -R *
tar -xf gv6.tar.bz2 -C /opt/biosoft/g16/gv
export PATH=/opt/biosoft/g16/gv/:$PATH


此条目发表在Quantum Chemical Calculation分类目录。将固定链接加入收藏夹。


电子邮件地址不会被公开。 必填项已用*标注

To create code blocks or other preformatted text, indent by four spaces:

    This will be displayed in a monospaced font. The first four 
    spaces will be stripped off, but all other whitespace
    will be preserved.
    Markdown is turned off in code blocks:
     [This is not a link](

To create not a block, but an inline code span, use backticks:

Here is some inline `code`.

For more help see

Protected with IP Blacklist CloudIP Blacklist Cloud