A finite difference method with phase-lag and its derivatives equal to zero for problems in chemistry
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Publication:2201045
DOI10.1007/S10910-020-01161-YzbMATH Open1448.65076OpenAlexW3047820812MaRDI QIDQ2201045FDOQ2201045
T. E. Simos, Maxim A. Medvedev
Publication date: 24 September 2020
Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1007/s10910-020-01161-y
initial value problemsderivative of the phase-lagoscillating solutionphase-lagmultistep methodSchrödinger equation
Particular ordinary differential operators (Dirac, one-dimensional Schrödinger, etc.) (34L40) Numerical solution of boundary value problems involving ordinary differential equations (65L10) Numerical methods for initial value problems involving ordinary differential equations (65L05)
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Cited In (6)
- Efficient FinDiff algorithm with optimal phase properties for problems in quantum chemistry
- A new algorithm with eliminated phase-lag and its derivatives up to order five for problems in quantum chemistry
- New FD scheme with vanished phase-lag and its derivatives up to order six for problems in chemistry
- A finite difference method with zero phase-lag and its derivatives for quantum chemistry problems
- A new economical method with eliminated phase-lag and its derivative for problems in chemistry
- Full in phase finite difference algorithm for differential equations in quantum chemistry
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