Question

[Pham Van Tien]

Câu 12

Cho 2 hàm sóng: \(\psi_{1s}=\frac{1}{\sqrt{\pi}}.a^{\frac{3}{2}}_0.e^{-\frac{r}{a_0}}\)và \(\psi_{2s}=\frac{1}{4\sqrt{2}}.a^{\frac{3}{2}}_0.\left(2-\frac{r}{a_0}\right).e^{-\frac{r}{2a_0}}\)

a) Hãy chứng minh hai hàm sóng trên trực giao nhau

b) Tìm hàm mật độ xác suất trong mỗi trường hợp và chỉ ra những vị trí mà mật độ xác suất đạt giá trị cực đại.

Answer 1

[lê thị hà]

a, Ta có:

Hai hàm sóng trực giao nhau khi  \(I=\int\psi_{1s}.\psi_{2s}d\psi=0\) \(\Leftrightarrow I=\iiint\psi_{1s}.\psi_{2s}dxdydz=0\)

Chuyển sang tọa độ cầu ta có:  \(\begin{cases}x=r.\cos\varphi.sin\theta\\y=r.\sin\varphi.sin\theta\\z=r.\cos\theta\end{cases}\)

\(\Rightarrow\)\(I=\frac{a^3_o}{4.\sqrt{2.\pi}}\int\limits^{\infty}_0\left(2-\frac{r}{a_o}\right).e^{-\frac{3.r}{2.a_o}}.r^2.\sin\theta dr\int\limits^{2\pi}_0d\varphi\int\limits^{\pi}_0d\theta\)

       \(=a^3_o.\sqrt{\frac{\pi}{2}}\)(.\(2.\int\limits^{\infty}_0r^2.e^{-\frac{3.r}{2.a_o}}dr-\frac{1}{a_o}.\int\limits^{\infty}_0r^3.e^{-\frac{3.r}{2.a_o}}dr\))

         \(=a_o.\sqrt{\frac{\pi}{2}}.\left(2.I_1-\frac{1}{a_o}.I_2\right)\)  

Tính \(I_1\):

Đặt \(r^2=u\); \(e^{-\frac{3r}{2a_o}}dr=dV\)

\(\Rightarrow\begin{cases}2.r.dr=du\\-\frac{2a_o}{3}.e^{-\frac{3r}{2a_o}}=V\end{cases}\)    \(\Rightarrow I_1=-r^2.\frac{2a_o}{3}.e^{-\frac{3r}{2a_o}}+\frac{4.a_o}{3}.\int\limits^{\infty}_0r.e^{-\frac{3r}{2a_o}}dr\)\(=0+\frac{4a_o}{3}.I_{11}\)

Tính \(I_{11}\):

Đặt r=u; \(e^{-\frac{3r}{2a_o}}dr=dV\)\(\Rightarrow\begin{cases}dr=du\\-\frac{2a_o}{3}.e^{-\frac{3r}{2a_o}}=V\end{cases}\)\(\Rightarrow I_{11}=0+\frac{2a_0}{3}.\int\limits^{\infty}_0e^{-\frac{3r}{2a_o}}dr=\frac{4a^2_o}{9}\)

\(\Rightarrow2.I_1=2.\frac{4a_o}{3}.\frac{4a_o^2}{9}=\frac{32a^3_o}{27}\)

Tính \(I_2\):

Đặt \(r^2=u;e^{-\frac{3r}{2a_o}}dr=dV\) \(\Rightarrow\)\(3r^2dr=du;-\frac{2a_o}{3}.e^{-\frac{3r}{2a_o}}=V\)

\(\Rightarrow I_2=0+2.a_o.\int\limits^{\infty}_0r^2.e^{-\frac{3r}{2a_o}}dr\)\(\Rightarrow\frac{1}{a_o}.I_2=2a_o.\frac{16a^3_o}{27}.\frac{1}{a_o}=\frac{32a^3_o}{27}\)

\(\Rightarrow I=a^3_o.\sqrt{\frac{\pi}{2}}.\left(\frac{32a^3_o}{27}-\frac{32a^3_o}{27}\right)=0\)

Vậy hai hàm sóng này trực giao với nhau.

b,

Xét hàm \(\Psi_{1s}\):

Hàm mật độ sác xuất là: \(D\left(r\right)=\Psi^2_{1s}=\frac{1}{\pi}.a^3_o.e^{-\frac{2r}{a_o}}\)

\(\Rightarrow D'\left(r\right)=-\frac{2.a_o^2}{\pi}.e^{-\frac{2r}{a_o}}=0\)

\(\Rightarrow\)Hàm đạt cực đại khi \(r\rightarrow o\) nên hàm sóng có dạng hình cầu.

Xét hàm \(\Psi_{2s}\):

Hàm mật độ sác xuất: \(D\left(r\right)=\Psi_{2s}^2=\frac{a^3_o}{32}.\left(2-\frac{r}{a_o}\right)^2.e^{-\frac{r}{a_0}}\)\(\Rightarrow D'\left(r\right)=\left(2-\frac{r}{a_o}\right).e^{-\frac{r}{a_o}}.\left(-4+\frac{r}{a_o}\right)=0\)

\(\Rightarrow r=2a_o\Rightarrow D\left(r\right)=0\); \(r=4a_o\Rightarrow D\left(r\right)=\frac{a^3_o}{8}.e^{-4}\)

Vậy hàm đạt cực đại khi \(r=4a_o\), tại \(D\left(r\right)=\frac{a^3_o}{8}.e^{-4}\)

Answer 2

[trần thị hương giang _ 20135410]

hai hàm trực giao: I=\(\int\)\(\Psi\)*\(\Psi\)d\(\tau\)=0

Ta có: I=\(\int\limits^{ }_x\)\(\int\limits^{ }_y\)\(\int\limits^{ }_z\)\(\Psi\)*\(\Psi\)dxdydz=0

           =\(\int\limits^{ }_r\)\(\int\limits^{ }_{\theta}\)\(\int\limits^{ }_{\varphi}\)\(\Psi\)_1s\(\Psi\)_2sr²sin\(\theta\)drd\(\theta\)d\(\varphi\)

          =\(\int\limits^{\infty}_0\)\(\int\limits^{\pi}_0\)\(\int\limits^{2\pi}_0\)(2-\(\frac{r}{a_0}\)).e^-3r/a₀r²sin\(\theta\)drd\(\theta\)d\(\varphi\)

          =C.\(\int\limits^{\infty}_0\)(2-\(\frac{r}{a_0}\)).e^-3r/a₀r2dr.\(\int\limits^{\pi}_0\)sin\(\theta\)\(\int\limits^{2\pi}_0\)d\(\varphi\)

 với C=\(\frac{1}{4\sqrt{2\pi}}\)a₀^-3

 Xét tích phân: J=\(\int\limits^{\infty}_0\)(2-\(\frac{r}{a_0}\)).e^-3r/a₀r²dr

 =\(\int\limits^{\infty}_0\)(2r²- \(\frac{r^3}{a_0}\)).e^-3r/a₀dr

 =\(\int\limits^{\infty}_0\)(2r²- \(\frac{r^3}{a_0}\)).\(\frac{-2a_0}{3}\)de^-3r/a₀

  =\(\frac{-2a_0}{3}\).((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀\(-\)\(\int\)(4r-\(\frac{3r^2}{a_0}\))e^-3r/adr)

 =\(\frac{-2a_0}{3}\)((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ - \(\int\)(4r-\(\frac{3r^2}{a_0}\)).\(\frac{-2a_0}{3}\)de^-3r/a)

 =\(\frac{-2a_0}{3}\)((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ +\(\frac{2a_0}{3}\).((4r-\(\frac{3r^2}{a_0}\))e^-3r/a₀ - \(\int\)(4 - \(\frac{6r}{a_0}\))e^-3r/a₀dr))

 =\(\frac{-2a_0}{3}\)((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ +\(\frac{2a_0}{3}\).((4r-\(\frac{3r^2}{a_0}\))e^-3r/a₀- \(\int\)(4 - \(\frac{6r}{a_0}\))\(\frac{-2a_0}{3}\).de^-3r/a₀))

 =\(\frac{-2a_0}{3}\)(((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ +\(\frac{2a_0}{3}\).((4r-\(\frac{3r^2}{a_0}\))e^-3r/a₀+\(\frac{2a_0}{3}\)((4-\(\frac{6r}{a_0}\)).e^-3r/a₀ + \(\int\)(\(\frac{6}{a_0}\)e^-3r/a₀dr)))

=\(\frac{-2a_0}{3}\)(((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ +\(\frac{2a_0}{3}\).((4r-\(\frac{3r^2}{a_0}\))e^-3r/a₀+\(\frac{2a_0}{3}\)((4-\(\frac{6r}{a_0}\)).e^-3r/a₀ + \(\int\)(\(\frac{6}{a_0}\).\(\frac{-2a_0}{3}\)de^-3r/a₀)))

=\(\frac{-2a_0}{3}\)((((2r²-\(\frac{r^3}{a_0}\))e^-3r/a₀ +\(\frac{2a_0}{3}\).((4r-\(\frac{3r^2}{a_0}\))e^-3r/a₀+\(\frac{2a_0}{3}\)((4-\(\frac{6r}{a_0}\)).e^-3r/a₀ - 4.e^-3r/a₀))))

=\(\frac{-2a_0}{3}\)e^-3r/a₀.\(\frac{-r^3}{a_0}\)=2/3.e^-3r/a₀.r³Thế cận tích phân 0 và \(\infty\)            J= 0 suy ra I=0. Vậy 2 hàm số trực giao