DL Visualize

  • strict warning: Non-static method view::load() should not be called statically in /home/vasp/wwwroot/drupal-6.33/sites/all/modules/views/views.module on line 906.
  • strict warning: Declaration of views_handler_argument::init() should be compatible with views_handler::init(&$view, $options) in /home/vasp/wwwroot/drupal-6.33/sites/all/modules/views/handlers/views_handler_argument.inc on line 744.
  • strict warning: Declaration of views_plugin_row::options_validate() should be compatible with views_plugin::options_validate(&$form, &$form_state) in /home/vasp/wwwroot/drupal-6.33/sites/all/modules/views/plugins/views_plugin_row.inc on line 134.
  • strict warning: Declaration of views_plugin_row::options_submit() should be compatible with views_plugin::options_submit(&$form, &$form_state) in /home/vasp/wwwroot/drupal-6.33/sites/all/modules/views/plugins/views_plugin_row.inc on line 134.
最新版本: 
3.3
评分: 
3

简介  
图形用户界面,具有到CRYSTAL98/03的接口。它可以显示和编辑二维(表面)和三维(晶体)周期结构,创建输入文件,分析计算结果。可以下载DEMO版。教育用户可以免费获取。

功能  
计算和显示LEED图案;
识别晶体和层面方向的密勒指数;
把显示的图像保存为图像或VRML;
支持2D或3D数据集;
到CRYSTAL 03/98的接口:可以本地或远程运行任务,显示电荷密度或自旋密度的等值面图或等高线图,绘制态密度,绘制能带图;
到DL_EXCURV 1.0的接口;
到GULP的接口;
已注册用户访问英国化学数据库服务器;
支持远程任务提交。