Reciprocal lattice and k-lattice belong to different class of lattices 是不是你优化改变结构比较大，...
错误1:VERY BAD NEWS! Internal error in subroutine IBZKPT: Reciprocallattice and k-lattice belong todi错误1:VERY BAD NEWS! Internal error in subroutine IBZKPT: Reciprocal lattice and k-lattice belong todifferent class of lattices. Often results are still useful... 48 Internal内部 subroutine...
所有能使得生成的平面波具有给定布拉维格子的周期性的波矢 k 的集合,称为布拉维格子的倒格子(reciprocal lattice)。 平面波具有和布拉维格子相同的周期性,翻译成数学语言就是,对任意的位矢 r 和任意布拉维格子中的 R ,都有: eik⋅(r+R)=eik⋅r 内积具有线性性,上式变为对任意布拉维格子中的 R: eik...
1) reciprocal lattice 倒易格点 2) reciprocity 倒易 3) reciprocal space 倒易空间 1. The universal expression of Laue equation and two theorems onreciprocal spaceand reciprocal vector are obtained and proved. 讨论和研究了干涉函数对衍射的影响,提出并证明了Laue方程的一般表达式和有关倒易空间与倒易向量...
The mathematical construction of a three-dimensional direct space lattice can be translated into an equivalent three-dimensional reciprocal space lattice. Such a mapping is achieved by using the rel…
In crystallography, the reciprocal lattice of a Bravais lattice is the set of all vectors K such that e^{imathbf{K}cdotmathbf{R}}=1 for all lattice point position vectors R. This reciprocal lattice is itself a Bravais lattice, and the reciprocal of the reciprocal lattice is the original ...
Define Reciprocal Movement. Reciprocal Movement synonyms, Reciprocal Movement pronunciation, Reciprocal Movement translation, English dictionary definition of Reciprocal Movement. also re-en·try n. pl. re·en·tries also re-en·tries 1. a. The act or ac
reciprocal lattice reciprocal laying reciprocal leveling reciprocal mass reciprocal matrix reciprocal ohm reciprocal ohm centimeter reciprocal ohm meter reciprocal polar figures reciprocal ratio reciprocal recombination reciprocal series reciprocal space ▼ Full browser ? ▲ recipient area recipient area recipient ...
13 现在已经解决了，我是重新截面然后加真空层再提交没有问题了，但是和之前的POSCAR还有KPOINTS差别不大...
reciprocal lattice reciprocal laying reciprocal leveling reciprocal mass reciprocal matrix reciprocal ohm reciprocal ohm centimeter reciprocal ohm meter reciprocal polar figures reciprocal ratio reciprocal recombination reciprocal series reciprocal space reciprocal spiral ...