# v0.0.19 - <span class="timestamp-wrapper"><span class="timestamp">[2019-04-29 Mon]</span></span>

-   add \`supercell\` cmd for making supercell
-   fixed \`avail\` cmd
-   add Gaussian BBM template
-   update dependencies


# v0.0.18 - <span class="timestamp-wrapper"><span class="timestamp">[2019-04-06 Sat]</span></span>

-   improved bbm templates for SIESTA/VASP
-   bbmrun: use a persistent scratch directory when optimization


# v0.0.17 - <span class="timestamp-wrapper"><span class="timestamp">[2019-02-08 Fri]</span></span>

-   use fixed crate versions as dependencies
-   remove neb mod (moved to nebrun crate)


# v0.0.16 - <span class="timestamp-wrapper"><span class="timestamp">[2019-01-25 Fri]</span></span>

-   added golden section search algorithm
-   improved BlackBox model docs


# v0.0.15 - <span class="timestamp-wrapper"><span class="timestamp">[2018-11-11 Sun]</span></span>

-   更新linefeed至新版, 解除对ncurses系统库的依赖.
-   解决bbmrun命令中, lbfgs返回错误代码的问题
-   解决bbmrun命令无法输出优化后的结构


# v0.0.14 - <span class="timestamp-wrapper"><span class="timestamp">[2018-10-31 Wed]</span></span>

-   将parser部分代码独立为一个新的crate: textparser
-   添加CG优化算法


# v0.0.13 - <span class="timestamp-wrapper"><span class="timestamp">[2018-10-07 Sun]</span></span>

-   改进apps/optimization相关接口设计.
-   添加nebrun子程序, 用于NEB优化.


# v0.0.12 - <span class="timestamp-wrapper"><span class="timestamp">[2018-10-06 Sat]</span></span>

-   models模拟中添加BlackBox模型, 方便调用任意外部模型.
-   添加相关命令行程序: bbmrun


# v0.0.11 - <span class="timestamp-wrapper"><span class="timestamp">[2018-09-29 Sat]</span></span>

-   runner添加\`-o\`选项, 保存计算后的结构
-   计算后的能量保存为分子的title/name


# v0.0.5 - <span class="timestamp-wrapper"><span class="timestamp">[2018-06-08 Fri]</span></span>

新增format命令, 可以根据自己的需求设计输出模板, 比如gulp, siesta等, gosh可以根据模板定义, 替换原子坐标等分子信息, 自动生成对应的输入文件.