Sökning: WFRF:(Tu Yaoquan) > A new relativistic ...
Fältnamn | Indikatorer | Metadata |
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000 | 02780naa a2200457 4500 | |
001 | oai:DiVA.org:kth-52545 | |
003 | SwePub | |
008 | 111219s2011 | |||||||||||000 ||eng| | |
024 | 7 | a https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-525452 URI |
024 | 7 | a https://doi.org/10.1088/0953-4075/44/22/2250072 DOI |
040 | a (SwePub)kth | |
041 | a engb eng | |
042 | 9 SwePub | |
072 | 7 | a ref2 swepub-contenttype |
072 | 7 | a art2 swepub-publicationtype |
100 | 1 | a He, Limingu KTH,Teoretisk kemi och biologi4 aut0 (Swepub:kth)u1bidr45 |
245 | 1 0 | a A new relativistic Hartree-Fock calculation scheme and its application to the evaluation of fine-structure intervals for nd (n=3-40) series of sodium |
264 | c 2011-11-08 | |
264 | 1 | b IOP Publishing,c 2011 |
338 | a print2 rdacarrier | |
500 | a QC 201112220 | |
520 | a We present a new second-order representation of the relativistic Hartree-Fock equation, which can be solved by the standard Hartree-Fock technique. An alternative reduction for the magnetic part of the Breit interaction is presented in an explicit expression. A corresponding program has been developed, which improves significantly the scaled linear mesh introduced by Herman and Skillman. The structures for a number of atoms and ions are calculated and the agreement of our results with those published is excellent. We evaluate the fine-structure intervals of nd(n = 3-40) Rydberg series for sodium. The inverted fine-structure splitting values are obtained directly as the differences of eigenvalues obtained from a self-consistent field procedure. Taking into account the Gaunt effect enables the accuracy of the calculation to be substantially improved. The complete treatments reproduce very well the inverted fine structures along the Rydberg series and the relative difference between the present results and the experiments does not exceed 4.4%. | |
650 | 7 | a NATURVETENSKAPx Fysik0 (SwePub)1032 hsv//swe |
650 | 7 | a NATURAL SCIENCESx Physical Sciences0 (SwePub)1032 hsv//eng |
653 | a SELF-CONSISTENT FIELDS | |
653 | a ALKALI-METAL ATOMS | |
653 | a BREIT INTERACTION | |
653 | a RYDBERG STATES | |
653 | a MICROWAVE SPECTROSCOPY | |
653 | a MANY-BODY | |
653 | a CORE | |
653 | a INVERSIONS | |
653 | a RUBIDIUM | |
653 | a ENERGY | |
700 | 1 | a Zhu, Yunxia4 aut |
700 | 1 | a Zhang, Meng4 aut |
700 | 1 | a Tu, Yaoquanu KTH,Teoretisk kemi och biologi4 aut0 (Swepub:kth)u1kuh2ie |
710 | 2 | a KTHb Teoretisk kemi och biologi4 org |
773 | 0 | t Journal of Physics Bd : IOP Publishingg 44:22, s. 225007-q 44:22<225007-x 0953-4075x 1361-6455 |
856 | 4 8 | u https://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-52545 |
856 | 4 8 | u https://doi.org/10.1088/0953-4075/44/22/225007 |
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