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numexercises7_14 [2014/07/14 08:00]
bogner created
numexercises7_14 [2014/07/14 12:29]
bogner
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 ===== Numerical Exercises for Monday July 14 ===== ===== Numerical Exercises for Monday July 14 =====
  
-  ​In your favorite programming language, make a program to construct a $NxN$ matrix+  ​* Install Git, and try out some of the commands covered in Morten or Nicolas'​s lecture slides ({{:​computing.pdf|}} {{:​talentdftguides.pdf|}}) for your codes in the following problems. 
 + 
 +  * In your favorite programming language, make a program to construct a real symmetric ​$NxN$ matrix. Diagonalize it using the appropriate LAPACK or GSL routine, and write out some number of the lowest eigenvalues. (Suggestion:​ You might find it useful to use Mathematica (available on the ECT* computers) to diagonalize a small matrix that you can benchmark against.) This will help you test that you've linked to the GSL or LAPACK library. 
 +  
 +  * The code {{:​laguerre_general.f90.zip|}} calculates the generalized Laguerre polynomials that appear in the definition of the HO wf's, see {{:​ho_spherical.pdf| here}}. Use this subroutine to create a function or subroutine that calculates the HO wf's $R_{nl}(r)$.  
 +  
 +  * Check numerically that the constructed HO wf's are orthonormal. I.e., evaluate $\int r^2dr R_{nl}(r)R_{n'​l'​}(r)$. To do this, you will want to use Gaussian quadrature to discretize the integrals. Gaussian quadrature is discussed a bit in {{:​ho_spherical.pdf| }}. (Gauss-Laguerre quadrature is ideal for this problem, but plain old Gauss-Legendre quadrature, which is widely available in canned routines you can easily find via Google, is sufficient.)  
 + 
 +  * Construct the matrix elements of the Coulomb potential given by  
 + 
 +\begin{equation} 
 +\langle nl|V|n'​l\rangle = \int_0^{\infty}r^2dr R_{nl}(r}\frac{1}{r}R_{n'​l}(r)  
 +\end{equation} 
 + 
 +  * Construct the hamilton matrix $\langle nl|H|n'​l\rangle$ keeping all HO basis states $n,​n'<​N_{max}$. Diagonalize the matrix for increasing $N_{max}$ values for different values of the oscillator length parameter $b$ ("​oscl"​ in the code.) $b$ and $\hbar\omega$ are related by $b = \sqrt{(\hbar/​(m\omega)}$. ​ Plot your lowest eigenvalue for each $N_{max}$ as a function of $b$ (or $\hbar\omega$).  
 + 
 +  * Construct a subroutine that returns relative HO matrix elements of the Minnesota NN potential. The definition of the Minnesota potential and a sketch of how to proceed will be given on the black board.  
 + 
 +Here are  
 + 
numexercises7_14.txt · Last modified: 2014/07/14 13:40 by bogner