错误:搜索内容不能为空,请输入英文关键词
错误:关键词超出字数限制,请精简
高级检索

The linear response function \(\chi (\textbf{r}, \textbf{r}^{'})\): another perspective

  • Samir Kenouche,
  • Jorge I. Martínez-Araya

摘要

In this paper, we propose a conceptual approach to assign a “mathematical meaning” to the non-local function \(\chi (\textbf{r}, \mathbf{r'})\) χ ( r , r ) . Mathematical evaluation of this kernel remains difficult since it is a function depending on six Cartesian coordinates. The idea behind this approach is to look for a limit process in order to explore mathematically this non-local function. According to our approach, the bra \(\langle \chi ^{\xi }_{r'} \vert \) χ r ξ | is the linear functional that corresponds to any ket \(\vert \psi \rangle \) | ψ , the value \(\langle \textbf{r}' \vert \psi \rangle \) r | ψ . In condensed writing \(\langle \chi ^{\xi }_{r'} \vert \, \langle \textbf{r} \vert \psi \rangle = \langle \textbf{r}' \vert \psi \rangle \) χ r ξ | r | ψ = r | ψ , and this is achieved by exploiting the sifting property of the delta function that gives it the sense of a measure, i.e. measuring the value of \(\psi (\textbf{r})\) ψ ( r ) at the point \(\textbf{r}'\) r . It is worth noting that \(\langle \chi ^{\xi }_{r'} \vert \) χ r ξ | is not an operator in the sense that when it is applied on a ket, it produces a number \(\psi (\textbf{r} = \textbf{r}')\) ψ ( r = r ) and not a ket. The quantity \(\chi ^{\xi }_{r'} (\textbf{r})\) χ r ξ ( r ) proceed as nascent delta function, turning into a real delta function in the limit where \(\xi \rightarrow 0\) ξ 0 . In this regard, \(\chi ^{\xi }_{r'} (\textbf{r})\) χ r ξ ( r ) acts as a limit of an integral operator kernel in a convolution integration procedure.