标题: 运算结束的.log文件显示“Incomplete structures were deleted.“ [打印本页] 作者Author: AlvinC 时间: yesterday 20:49 标题: 运算结束的.log文件显示“Incomplete structures were deleted.“ 用超算跑了一个过渡态搜索任务,超算显示的工作状态是”COMPLETED”,不是“FAILED”。
但用GV打开.log文件显示“Incomplete structures were deleted.May be a restarted or incomplete job.”
文件打开后初始在第一个结构,手动调到最后一个结构后,可以看到只有一个虚频的计算结果。