DOI: 10.1063/1.461641. The absorption spectrum of a potassium atom in a Xe cluster

The absorption spectrum of a potassium atom in a Xe cluster

10.1063/1.461641

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

We calculate the absorption spectrum for a simple model that mimics a potassium atom in a Xe cluster. The time evolution of the electron wave function is calculated by a fast Fourier transform method while the nuclear motion is treated classically. The initial nuclear configurations are generated by a Monte Carlo method. We examine which features in the spectrum are caused by electron, potassium ion or Xe motion and the frequency resolution at which these features appear.

Bibliography

Haug, K., & Metiu, H. (1991). The absorption spectrum of a potassium atom in a Xe cluster. The Journal of Chemical Physics, 95(8), 5670â5680.

Authors 2

Kenneth Haug (first)
Horia Metiu (additional)

References 49 Referenced 20

{'key': '2024021011535521700_r1'}
10.1103/PhysRevB.26.4199 / Phys. Rev. B (1982)
10.1063/1.452495 / J. Chem. Phys. (1987)
10.1063/1.453759 / J. Chem. Phys. (1988)
10.1063/1.433821 / J. Chem. Phys. (1977)
10.1063/1.436029 / J. Chem. Phys. (1978)
10.1063/1.447820 / J. Chem. Phys. (1984)
10.1063/1.447501 / J. Chem. Phys. (1984)
10.1103/PhysRevA.38.2178 / Phys. Rev. A (1988)
10.1103/PhysRevLett.62.106 / Phys. Rev. Lett. (1989)
10.1063/1.455067 / J. Chem. Phys. (1988)
10.1063/1.458969 / J. Chem. Phys. (1990)
10.1063/1.454726 / J. Chem. Phys. (1988)
10.1016/0009-2614(88)80309-9 / Chem. Phys. Lett. (1988)
10.1063/1.452429 / J. Chem. Phys. (1987)
10.1021/j100318a006 / J. Phys. Chem. (1988)
10.1103/PhysRevLett.60.456 / Phys. Rev. Lett. (1988)
10.1016/0301-0104(89)80011-4 / Chem. Phys. (1989)
10.1063/1.456266 / J. Chem. Phys. (1989)
10.1021/j100326a009 / J. Phys. Chem. (1988)
10.1103/PhysRevLett.59.823 / Phys. Rev. Lett. (1987)
10.1103/PhysRevLett.56.2326 / Phys. Rev. Lett. (1986)
10.1063/1.456771 / J. Chem. Phys. (1989)
10.1103/PhysRevLett.64.1469 / Phys. Rev. Lett. (1990)
10.1063/1.455453 / J. Chem. Phys. (1988)
10.1021/j100338a010 / J. Phys. Chem. (1989)
{'key': '2024021011535521700_r21'}
10.1080/00268975900100401 / Mol. Phys. (1959)
10.1103/PhysRev.137.A490 / Phys. Rev. (1965)
10.1063/1.1697262 / J. Chem. Phys. (1965)
10.1016/0009-2614(87)80660-7 / Chem. Phys. Lett. (1987)
10.1146/annurev.pc.37.100186.002153 / Annu. Rev. Phys. Chem. (1986)
10.1063/1.445601 / J. Chem. Phys. (1983)
10.1016/0009-2614(87)80075-1 / Chem. Phys. Lett. (1987)
{'key': '2024021011535521700_r24', 'first-page': '129', 'volume': '10', 'year': '1976', 'journal-title': 'Appl. Phys.'} / Appl. Phys. (1976)
10.1063/1.454028 / J. Chem. Phys. (1988)
10.1063/1.458463 / J. Chem. Phys. (1990)
10.1063/1.453501 / J. Chem. Phys. (1987)
10.1063/1.458965 / J. Chem. Phys. (1990)
10.1103/PhysRevA.6.709 / Phys. Rev. A (1972)
10.1103/PhysRevA.6.720 / Phys. Rev. A (1972)
10.1063/1.437910 / J. Chem. Phys. (1979)
10.1063/1.449813 / J. Chem. Phys. (1985)
10.1016/0009-2614(86)80055-0 / Chem. Phys. Lett. (1986)
10.1103/PhysRev.159.98 / Phys. Rev. (1967)
10.1103/PhysRev.174.769 / Phys. Rev. (1968)
10.1063/1.446740 / J. Chem. Phys. (1984)
{'key': '2024021011535521700_r32'}
{'key': '2024021011535521700_r33'}

Dates

Type	When
Created	23 years, 1 month ago (July 26, 2002, 8:21 a.m.)
Deposited	1 year, 6 months ago (Feb. 10, 2024, 8:37 a.m.)
Indexed	1 year, 6 months ago (Feb. 10, 2024, 10 p.m.)
Issued	33 years, 10 months ago (Oct. 15, 1991)
Published	33 years, 10 months ago (Oct. 15, 1991)
Published Print	33 years, 10 months ago (Oct. 15, 1991)

Funders 0

None

BibTeX

@article{Haug_1991, title={The absorption spectrum of a potassium atom in a Xe cluster}, volume={95}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.461641}, DOI={10.1063/1.461641}, number={8}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Haug, Kenneth and Metiu, Horia}, year={1991}, month=oct, pages={5670–5680} }

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      "DOI": "10.1016/0009-2614(87)80075-1",
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