The Filterization Method to Calculate Eigenstates
1997 ◽
Vol 11
(03)
◽
pp. 295-302
Keyword(s):
We have proposed a new method to calculate low lying eigenstates of Hamiltonian operator for triatomic molecules. The method is a grid method based on continuously pumping flux onto the potential energy surface and gives the wave function overlapping with prechosen energy of interest. This energy may correspond to a bound state, a resonance or a continuum state. We have calculated several low lying bound state energies and corresponding bound state wave functions for HOCl with HO bond fixed at its equilibrium value.
Keyword(s):
1980 ◽
Vol 38
(2)
◽
pp. 157-184
◽
1983 ◽
Vol 94
(1)
◽
pp. 81-84
◽
Keyword(s):
2017 ◽
Vol 11
(1)
◽
pp. 1-8
◽
Keyword(s):
Keyword(s):
2019 ◽
Vol 15
(5)
◽
pp. 2780-2796
◽
2018 ◽
Vol 9
(12)
◽
pp. 3271-3277
◽
Keyword(s):
2003 ◽
Vol 125
(2)
◽
pp. 584-587
◽
Keyword(s):