000041804 001__ 41804
000041804 005__ 20200423203927.0
000041804 0247_ $$2DOI$$a10.1007/s00200-004-0156-6
000041804 0247_ $$2WOS$$aWOS:000224435700002
000041804 0247_ $$2Handle$$a2128/12067
000041804 0247_ $$2altmetric$$aaltmetric:3620571
000041804 037__ $$aPreJuSER-41804
000041804 041__ $$aeng
000041804 082__ $$a510
000041804 084__ $$2WoS$$aComputer Science, Interdisciplinary Applications
000041804 084__ $$2WoS$$aComputer Science, Theory & Methods
000041804 084__ $$2WoS$$aMathematics, Applied
000041804 1001_ $$0P:(DE-HGF)0$$aScott, T. C.$$b0
000041804 245__ $$aExchange Energy for Two-Active-Electron Diatomic Systems Within the Surface Integral Method
000041804 260__ $$aBerlin$$bSpringer$$c2004
000041804 300__ $$a101 - 128
000041804 3367_ $$0PUB:(DE-HGF)16$$2PUB:(DE-HGF)$$aJournal Article
000041804 3367_ $$2DataCite$$aOutput Types/Journal article
000041804 3367_ $$00$$2EndNote$$aJournal Article
000041804 3367_ $$2BibTeX$$aARTICLE
000041804 3367_ $$2ORCID$$aJOURNAL_ARTICLE
000041804 3367_ $$2DRIVER$$aarticle
000041804 440_0 $$012901$$aApplicable Algebra in Engineering, Communication and Computing$$v15$$x0938-1279
000041804 500__ $$aRecord converted from VDB: 12.11.2012
000041804 520__ $$aWe have analyzed and reduced a general (quantum-mechanical) expression for the atom-atom exchange energy formulated as a five-dimensional surface integral, which arises in studying the charge exchange processes in diatomic molecules. It is shown that this five-dimensional surface integral can be decoupled into a three-dimensional integral and a two-dimensional angular integral which can be solved analytically using a special decomposition. Exact solutions of the two-dimensional angular integrals are presented and generalized. Algebraic aspects, invariance properties and exact solutions of integrals involving Legendre and Chebyshev polynomials are also discussed.
000041804 536__ $$0G:(DE-Juel1)FUEK254$$2G:(DE-HGF)$$aBetrieb und Weiterentwicklung des Höchstleistungsrechners$$cI03$$x0
000041804 588__ $$aDataset connected to Web of Science
000041804 650_7 $$2WoSType$$aJ
000041804 65320 $$2Author$$asymbolic integration
000041804 65320 $$2Author$$anumerical integration
000041804 65320 $$2Author$$amolecular physics
000041804 65320 $$2Author$$aspecial functions and sums
000041804 65320 $$2Author$$aasymptotic series
000041804 7001_ $$0P:(DE-HGF)0$$aAubert-Frécon, M.$$b1
000041804 7001_ $$0P:(DE-HGF)0$$aAndrae, D.$$b2
000041804 7001_ $$0P:(DE-Juel1)132118$$aGrotendorst, J.$$b3$$uFZJ
000041804 7001_ $$0P:(DE-HGF)0$$aMorgan III, J. D.$$b4
000041804 7001_ $$0P:(DE-HGF)0$$aGlasser, M. L.$$b5
000041804 773__ $$0PERI:(DE-600)1458434-7$$a10.1007/s00200-004-0156-6$$gVol. 15, p. 101 - 128$$p101 - 128$$q15<101 - 128$$tApplicable algebra in engineering, communication and computing$$v15$$x0938-1279$$y2004
000041804 8567_ $$uhttp://dx.doi.org/10.1007/s00200-004-0156-6
000041804 8564_ $$uhttps://juser.fz-juelich.de/record/41804/files/ib-2004-02.pdf$$yOpenAccess
000041804 8564_ $$uhttps://juser.fz-juelich.de/record/41804/files/ib-2004-02.gif?subformat=icon$$xicon$$yOpenAccess
000041804 8564_ $$uhttps://juser.fz-juelich.de/record/41804/files/ib-2004-02.jpg?subformat=icon-180$$xicon-180$$yOpenAccess
000041804 8564_ $$uhttps://juser.fz-juelich.de/record/41804/files/ib-2004-02.jpg?subformat=icon-700$$xicon-700$$yOpenAccess
000041804 8564_ $$uhttps://juser.fz-juelich.de/record/41804/files/ib-2004-02.pdf?subformat=pdfa$$xpdfa$$yOpenAccess
000041804 909CO $$ooai:juser.fz-juelich.de:41804$$pdnbdelivery$$pVDB$$pdriver$$popen_access$$popenaire
000041804 9131_ $$0G:(DE-Juel1)FUEK254$$bInformation$$kI03$$lWissenschaftliches Rechnen$$vBetrieb und Weiterentwicklung des Höchstleistungsrechners$$x0
000041804 9141_ $$y2004
000041804 915__ $$0StatID:(DE-HGF)0510$$2StatID$$aOpenAccess
000041804 915__ $$0StatID:(DE-HGF)0010$$aJCR/ISI refereed
000041804 9201_ $$0I:(DE-Juel1)VDB62$$d31.12.2007$$gZAM$$kZAM$$lZentralinstitut für Angewandte Mathematik$$x0
000041804 970__ $$aVDB:(DE-Juel1)57968
000041804 980__ $$aVDB
000041804 980__ $$aConvertedRecord
000041804 980__ $$ajournal
000041804 980__ $$aI:(DE-Juel1)JSC-20090406
000041804 980__ $$aUNRESTRICTED
000041804 9801_ $$aFullTexts
000041804 981__ $$aI:(DE-Juel1)JSC-20090406