The crystal dependent open-shell polarizability of f-elements: higher order contributions
2000 (English)In: Journal of Alloys and Compounds, ISSN 0925-8388, E-ISSN 1873-4669, Vol. 303-304, no 24 May, p. 345-348Article in journal (Refereed) Published
Abstract [en]
It has earlier been shown that the use of a self consistent multipole electrostatic model to derive the crystal field parameters (CFP) actually gives the correct curve shape when the CFP are plotted against the various rare-earth ions (S. Edvardsson, M. Klintenberg, The use of CI calculated polarizabilities to study rare-earth CFP dependencies in the laser host RE:YLF. Mater. Sci. Forum, 1999;315-317:407). It is also known that the electrostatic contribution is important for the lower order parameters. In this connection; our primary interest is to revisit this model and investigate theoretically some aspects of the dipole polarizability (alpha(D)). A few approximations were done in the earlier calculations: the treatment of unfilled shells, the neglect that also higher order terms of the type A(10)r(t)C(0)(t) contribute with t odd (not only the A(10)r(1)C(0)(1) term), correlation effects and second order contributions in perturbation theory. The solutions of the inhomogeneous Schrodinger equation are solved by a powerful numerical method. The problem is reformulated and results instead in a simple linear equation system (symmetric tridiagonal matrix) which is stable and fast to solve. The various theoretical results will be used in future applications.
Place, publisher, year, edition, pages
2000. Vol. 303-304, no 24 May, p. 345-348
Keywords [en]
atomic physics, polarizability, rare-earth
National Category
Electrical Engineering, Electronic Engineering, Information Engineering
Identifiers
URN: urn:nbn:se:miun:diva-5192DOI: 10.1016/S0925-8388(00)00758-1ISI: 000087312600059Local ID: 578OAI: oai:DiVA.org:miun-5192DiVA, id: diva2:30224
Conference
22nd Rare Earth Research Conference ARGONNE NATL LAB, ARGONNE, ILLINOIS, JUL 11-15, 1999
Note
22nd Rare Earth Research Conference, Jul 11-15, 1999, Argonne, Illinois
2008-09-302008-09-302017-12-12Bibliographically approved