Concepedia

Orthogonal polynomial expansion of the spectral density operator and the calculation of bound state energies and eigenfunctions

Wei Zhu, Youhong Huang, Donald J. Kouri, Colston Chandler, David K. Hoffman

Chemical Physics Letters · 1994 · 98 citations · 16 references

DOI

Concepts

References

16

An accurate and efficient scheme for propagating the time dependent Schrödinger equation

Hillel Tal‐Ezer, Ronnie Kosloff · The Journal of Chemical Physics · 1984 · 1.5K citations

, , +14

Quantum mechanical rate constants for bimolecular reactions

William H. Miller, Steven D. Schwartz, John W. Tromp · The Journal of Chemical Physics · 1983 · 919 citations

, , +13

A direct relaxation method for calculating eigenfunctions and eigenvalues of the schrödinger equation on a grid

Ronnie Kosloff, Hillel Tal‐Ezer · Chemical Physics Letters · 1986 · 703 citations

, , +12

Calculation of the cumulative reaction probability via a discrete variable representation with absorbing boundary conditions

Tamar Seideman, William H. Miller · The Journal of Chemical Physics · 1992 · 366 citations

, , +14

Semiclassical calculation of bound states in a multidimensional system. Use of Poincaré’s surface of section

D. W. Noid, R. A. Marcus · The Journal of Chemical Physics · 1975 · 258 citations

, , +11