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Volumn 309, Issue 5738, 2005, Pages 1219-1222

Chemistry: Understanding the infrared spectrum of bare CH5 +

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; FINITE ELEMENT METHOD; HYDROGEN; MOLECULAR DYNAMICS; SPECTRUM ANALYSIS;

EID: 23844534418     PISSN: 00368075     EISSN: None     Source Type: Journal    
DOI: 10.1126/science.1113729     Document Type: Article
Times cited : (186)

References (38)
  • 23
    • 33645350635 scopus 로고    scopus 로고
    • For an animation of the scrambling dynamics, see www.theochem.rub.de/go/ ch5p.html.
  • 30
    • 0000323669 scopus 로고    scopus 로고
    • J. Grotendorst, Ed. [John von Neumann-Institut für Computing (NIC), Forschungszentrum Jülich, Jülich, Germany]
    • D. Marx, J. Hutter, in Modern Methods and Algorithms of Quantum Chemistry, J. Grotendorst, Ed. [John von Neumann-Institut für Computing (NIC), Forschungszentrum Jülich, Jülich, Germany, 2000], pp. 301-449 (available at www.theochem.rub.de/go/cprev.html).
    • (2000) Modern Methods and Algorithms of Quantum Chemistry , pp. 301-449
    • Marx, D.1    Hutter, J.2
  • 31
    • 77950242194 scopus 로고
    • Max-Planck-Institut für Festkörperforschung and IBM Zürich
    • J. Mutter et al., CPMD Software Package, Max-Planck-Institut für Festkörperforschung and IBM Zürich (1995-1999).
    • (1995) CPMD Software Package
    • Mutter, J.1
  • 38
    • 33645359480 scopus 로고    scopus 로고
    • note
    • Supported by Deutsche Forschungsgemeinschaft (DFG) Forschergruppe FOR 388 ("Laboratory Astrophysics") and DFG grant MA 1547/4-1, the Netherlands Research School for Astronomy (NOVA), Fonds der Chemischen Industrie, and a Netherlands Organization for Scientific Research (NWO) Spinoza grant (OA). The Bochum group thanks A. Chandra, H. Forbert, A. Kohlmeyer, and H. Langer for useful discussions and technical help; the simulations were carried out at BOVILAB@RUB (Bochum). The Leiden/Köln group thanks FOM for beam time and highly appreciates the skillful assistance by the FELIX staff and by the workshops of Leiden University. S.S. thanks D, Gerlich for the opportunity to transfer the 22-pole ion trap machine to Leiden/Köln in order to continue the work on LIR.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.