ZIB

Hits per page

hit 1 - 1 | 1 hit

Sorting

Electronic Resource

A density-functional calculation of dynamic dipole polarizabilities of noble gas atoms (1983)

Ghosh, S. K. ; Deb, B. M.

Springer

Theoretical chemistry accounts 62 (1983), S. 209-217

add to mindlist on the mindlist

Details

ISSN: 1432-2234

Keywords: Density-functional theory ; Dynamic polarizability ; Noble gas atoms ; Variation-perturbation method ; Direct density calculation

Source: Springer Online Journal Archives 1860-2000

Topics: Chemistry and Pharmacology

Notes: Abstract Using a very simple trial function and unperturbed electron densities calculated by a new procedure, the frequency-dependent dipole polarizability α (ω) of Ne, Ar, Kr and Xe has been calculated in the range 0 ≤ ω ≤ 0.45 a.u., by a Karplus-Kolker-type variation-perturbation method. Results progressively worsen for larger systems so that, for Xe, α(0) is only 75% of the experimental value. Probable reasons for this are discussed.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1007/BF00548835

Permalink

Library	Location	Call Number	Volume/Issue/Year	Availability

Others were also interested in ...

Paper (German National Licenses)

Fulltext

hit 1 - 1 | 1 hit