lammps atom_style翻译 使用语法 atom_style style args 其中:▪style可取:angle or atomic or body or bond or charge or dipole or electron or ellipsoid or fullor line or meso or molecular or peri or sphere or tri or hybrid ...
lammps atom_style翻译.docx,使用语法atom_style style args其中:style可取:angle?or?atomic?or?body?or?bond?or?charge?or?dipole?or?electron?or?ellipsoid?or?fullor?line?or?meso?or?molecular?or?peri?or?sphere?or?tri?or?hybrid只有body和hybrid需要设置args(具体
Single-crystal X-ray analyses of these compounds provide d(N−N) bond length values of 1.518(2), 1.581(4), 1.600(6), 1.611(4), 1.630(4), and 1.635(5) Å for 1−6, respectively, that correlate with an increasing fold angle of the M2N2 core for an increase in d(N−N)....
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尽量使用更加通用的类型虽然这可能会因为某些属性没有用到同时会稍微降低效率但总比出错类型的选择会影响每个原子所能够存储的性质在计算力的时候处理器间能够交换的性质以及在数据文件中所能够显示并被命令readdata读入的性质 使用语法 atom_style style args 其中: style 可取: angle or atomic or body or ...