按一篇文文献上的,先建立了含一水层的Na-蒙托石模型,然后进行discover minimizer计算优化,可是出现了如下问题(具体可以看附件图里面的):“Failed to add energy server contribution to the Job.
Failed to prepare structure for a forcefield based calculation.
The typing engine has failed to calculate a forcefield type for 1 atom.
The charging engine has failed to calculate a charge for 1 atoms.”
该怎么办?网上说要指定各个原子的力场,那该如何做?请高人详细讲解讲解,谢谢各位了!!