English

Hermitian Hamiltonians: Matrix versus Schr${\"o}$dinger's

General Physics 2016-08-08 v2

Abstract

We draw attention to the fact that a Hermitian matrix is always diagonalizable and has real discrete spectrum whereas the Hermitian Schr{\"o}dinger Hamiltonian: H=p2/2μ+V(x)H=p^2/2\mu+V(x), may not be so. For instance when V(x)=x,x3,x2V(x)=x, x^3, -x^2, HH does not have even one real discrete eigenvalue. Textbooks do not highlight this distinction. However, if HH has real discrete spectrum, by virtue of the expansion theorem, one can convert the eigenvalue problem Hψn=EnψnH\psi_n=E_n \psi_n into a matrix and get eigenvalues EnE_n by diagonalizing the matrix. We show, that the thus obtained EnE_n could be accurate, provided HH is devoid of scattering states. We suggest that this could be a simple and apt way to introduce the method of Linear Combination of Atomic Orbitals (LCAO) for finding the spectra of molecules. In textbooks, usually the method of matrix-diagonalization appears meagerly as a degenerate perturbation theory for more than one dimensions.

Keywords

Cite

@article{arxiv.1608.01543,
  title  = {Hermitian Hamiltonians: Matrix versus Schr${\"o}$dinger's},
  author = {Zafar Ahmed and Mohammad Irfan and Achint Kumar and Ankush Singhal},
  journal= {arXiv preprint arXiv:1608.01543},
  year   = {2016}
}

Comments

10 pages, 3 figures and 1 Table

R2 v1 2026-06-22T15:12:21.078Z