标题: DFTB和DFTBA区别是什么？ [打印本页] 作者Author: archer 时间: 2021-5-6 18:13 标题: DFTB和DFTBA区别是什么？ DFTB uses the tabulated matrix elements as in the original implementation of Elstner and coworkers [Porezag95, Elstner98].
DFTBA is a version that uses analytic expressions for the matrix elements rather than tabulated ones [Zheng07].
在Gaussian中的区别是什么？
作者Author: sobereva 时间: 2021-5-7 03:27 (, 下载次数 Times of downloads: 24)