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Volumn , Issue , 2004, Pages 555-565

Structure and dynamics of concentrated hydrochloric acid solutions. A first principles molecular dynamics study

Author keywords

[No Author keywords available]

Indexed keywords

CHLORIDE; DEUTERIUM; HYDROCHLORIC ACID; HYDROFLUORIC ACID; HYDROGEN; ION; OXYGEN; PROTON; WATER;

EID: 1542719812     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/b307279g     Document Type: Article
Times cited : (28)

References (71)
  • 30
    • 85034795084 scopus 로고    scopus 로고
    • FINGER has mainly been developed at Helsinki University of Technology, Espoo, Finland
    • FINGER has mainly been developed at Helsinki University of Technology, Espoo, Finland
  • 44
    • 69249186596 scopus 로고    scopus 로고
    • CSCS/ETHZ, Zurich, Switzerland
    • S. Portman, Molekel, CSCS/ETHZ, Zurich, Switzerland, http://www.cscs.ch/molekel/
    • Molekel
    • Portman, S.1
  • 57
    • 0003451443 scopus 로고
    • Our spectra have been smoothed using the Blackman window to reduce noise as suggested in, Clarendon Press, Oxford
    • Our spectra have been smoothed using the Blackman window to reduce noise as suggested in M. P. Allen and D. J. Tildesley, Computer Simulations of Liquids, Clarendon Press, Oxford, 1989
    • (1989) Computer Simulations of Liquids
    • Allen, M.P.1    Tildesley, D.J.2
  • 61
    • 85034795980 scopus 로고    scopus 로고
    • D projection onto corresponding OD-bonds and bending from the OD-bond unit vectors
    • D projection onto corresponding OD-bonds and bending from the OD-bond unit vectors
  • 63
    • 0034504583 scopus 로고    scopus 로고
    • A. Luzar J. Chem. Phys., 2000, 113, 10 663-10 675
    • (2000) J. Chem. Phys. , vol.113 , pp. 10 663-10 675
    • Luzar, A.1
  • 64
    • 85034794253 scopus 로고    scopus 로고
    • lag2 = 200 fs
    • lag2 = 200 fs
  • 69
    • 0003516749 scopus 로고
    • Oxford University Press, Oxford, 5th edn
    • P. W. Atkins, Physical Chemistry, Oxford University Press, Oxford, 5th edn., 1994
    • (1994) Physical Chemistry
    • Atkins, P.W.1
  • 70
    • 85034793039 scopus 로고    scopus 로고
    • -1)
    • -1)


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.