Home > Publications database > New Approach for the Electronic Energies of the Hydrogen Molecular Ion > print |
001 | 54814 | ||
005 | 20200423204415.0 | ||
024 | 7 | _ | |a 10.1016/j.chemphys.2005.10.031 |2 DOI |
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037 | _ | _ | |a PreJuSER-54814 |
041 | _ | _ | |a eng |
082 | _ | _ | |a 540 |
084 | _ | _ | |2 WoS |a Chemistry, Physical |
084 | _ | _ | |2 WoS |a Physics, Atomic, Molecular & Chemical |
100 | 1 | _ | |a Scott, T. C. |b 0 |0 P:(DE-HGF)0 |
245 | _ | _ | |a New Approach for the Electronic Energies of the Hydrogen Molecular Ion |
260 | _ | _ | |a Amsterdam [u.a.] |b Elsevier Science |c 2006 |
300 | _ | _ | |a |
336 | 7 | _ | |a Journal Article |0 PUB:(DE-HGF)16 |2 PUB:(DE-HGF) |
336 | 7 | _ | |a Output Types/Journal article |2 DataCite |
336 | 7 | _ | |a Journal Article |0 0 |2 EndNote |
336 | 7 | _ | |a ARTICLE |2 BibTeX |
336 | 7 | _ | |a JOURNAL_ARTICLE |2 ORCID |
336 | 7 | _ | |a article |2 DRIVER |
440 | _ | 0 | |a Chemical Physics |x 0301-0104 |0 9841 |y 2 |v 324 |
500 | _ | _ | |a Record converted from VDB: 12.11.2012 |
520 | _ | _ | |a Herein, we present analytical solutions for the electronic energy eigenvalues of the hydrogen molecular ion H-2(+), namely the one-electron two-fixed-center problem. These are given for the homonuclear case for the countable infinity of discrete states when the (2)Sigma(+) states. In this case, these solutions are the roots of a set of two coupled three-term magnetic quantum number m is zero, i.e., for, recurrence relations. The eigensolutions are obtained from an application of experimental mathematics using Computer Algebra as its principal tool and are vindicated by numerical and algebraic demonstrations. Finally, the mathematical nature of the eigenenergies is identified. (c) 2005 Elsevier B.V. All rights reserved. |
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588 | _ | _ | |a Dataset connected to Web of Science |
650 | _ | 7 | |a J |2 WoSType |
700 | 1 | _ | |a Aubert-Frécon, M. |b 1 |0 P:(DE-HGF)0 |
700 | 1 | _ | |a Grotendorst, J. |b 2 |u FZJ |0 P:(DE-Juel1)132118 |
773 | _ | _ | |a 10.1016/j.chemphys.2005.10.031 |g Vol. 324 |q 324 |0 PERI:(DE-600)1501546-4 |t Chemical physics |v 324 |y 2006 |x 0301-0104 |
856 | 7 | _ | |u http://dx.doi.org/10.1016/j.chemphys.2005.10.031 |
856 | 4 | _ | |u https://juser.fz-juelich.de/record/54814/files/ib-2005-09.pdf |y OpenAccess |
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913 | 1 | _ | |k P41 |v Scientific Computing |l Supercomputing |b Schlüsseltechnologien |0 G:(DE-Juel1)FUEK411 |x 0 |
914 | 1 | _ | |y 2006 |
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915 | _ | _ | |a JCR/ISI refereed |0 StatID:(DE-HGF)0010 |
920 | 1 | _ | |k ZAM |l Zentralinstitut für Angewandte Mathematik |d 31.12.2007 |g ZAM |0 I:(DE-Juel1)VDB62 |x 0 |
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