Journal of Physical Chemistry A

Journal of Physical Chemistry A

ISSNs: 1089-5639, 1520-5215

American Chemical Society, United States

Scopus rating (2022): CiteScore 5 SJR 0.675 SNIP 0.841

Journal

Journal Metrics

Research Output

  1. 2010
  2. Ab initio prediction of amorphous B84

    Shang, B., Yuan, L., Zeng, X. C. & Yang, J., 18 Feb 2010, In: Journal of Physical Chemistry A. 114, 6, p. 2245-2249

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 32
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  3. Published

    DFT/TD-DFT investigation of electronic structures and spectra properties of Cu-based dye sensitizers

    Lu, X., Wu, C. L., Wei, S. & Guo, W., 21 Jan 2010, In: Journal of Physical Chemistry A. 114, 2, p. 1178-1184

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 40
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  4. Effects of the polymorphic transformation of glutaric acid particles on their deliquescence and hygroscopic properties

    Yeung, M. C., Ling, T. Y. & Chan, C. K., 21 Jan 2010, In: Journal of Physical Chemistry A. 114, 2, p. 898-903

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 24
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  5. Published

    Cooperative effect of solvent in the neutral hydration of ketenimine: An ab initio study using the hybrid cluster/Continuum model

    Sun, X., Wei, X., Wu, X., Ren, Y., Wong, N. & Li, W., 14 Jan 2010, In: Journal of Physical Chemistry A. 114, 1, p. 595-602

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 25
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  6. 2009
  7. Published

    High-level ab initio predictions for the ionization energy, bond dissociation energies, and heats of formations of iron carbide (FeC) and its cation (FeC+)

    Lau, K., Chang, Y., Lam, C. & Ng, C. Y., 31 Dec 2009, In: Journal of Physical Chemistry A. 113, 52, p. 14321-14328

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 31
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  8. Search for Lowest-Energy Nonclassical Fullerenes III: C22

    Killblane, C., Gao, Y., Shao, N. & Zeng, X. C., 6 Aug 2009, In: Journal of Physical Chemistry A. 113, 31, p. 8839-8844

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 19
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  9. Published

    Conformation-Specific Pathways of β-Alanine: A Vacuum Ultraviolet Photoionization and Theoretical Study

    Zhang, L., Pan, Y., Guo, H., Zhang, T., Sheng, L., Qi, F., Lo, P., & 1 othersLau, K., 21 May 2009, In: Journal of Physical Chemistry A. 113, 20, p. 5838-5845

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 19
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  10. Ab initio study of structural, electronic, and magnetic properties of V n (C 60) m Complexes

    Zhang, X., Wang, J. & Zeng, X. C., 7 May 2009, In: Journal of Physical Chemistry A. 113, 18, p. 5406-5413

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 17
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  11. Published

    Rovibronically selected and resolved two-color laser photoionization and photoelectron study of the iron carbide cation

    Chang, Y. C., Lam, C., Reed, B., Lau, K. C., Liou, H. T. & Ng, C. Y., 23 Apr 2009, In: Journal of Physical Chemistry A. 113, 16, p. 4242-4248

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 33
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  12. Published

    Structures and properties of closed ladderanes C24H 24, laddersilanes Si24H24, and their nitrogen-containing isoelectronic equivalents: A G3(MP2) investigation

    WANG, X., Lau, K. & Li, W., 9 Apr 2009, In: Journal of Physical Chemistry A. 113, 14, p. 3413-3419

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 7
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  13. Onset of double helical structure in small-sized homoleptic gold thiolate clusters

    Shao, N., Pei, Y., Gao, Y. & Zeng, X. C., 29 Jan 2009, In: Journal of Physical Chemistry A. 113, 4, p. 629-632

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 38
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  14. 2008
  15. Compound I in heme thiolate enzymes: A comparative QM/MM study

    Cho, K., Hirao, H., Chen, H., Carvajal, M. A., Cohen, S., Derat, E., Thiel, W., & 1 othersShaik, S., 18 Dec 2008, In: Journal of Physical Chemistry A. 112, 50, p. 13128-13138

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 30
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  16. Binding energies of the silver ion to alcohols and amides: A theoretical and experimental study

    Romanov, V., Siu, C., Verkerk, U. H., El Aribi, H., Hopkinson, A. C. & Siu, K. W. M., 30 Oct 2008, In: Journal of Physical Chemistry A. 112, 43, p. 10912-10920

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 26
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  17. 2007
  18. Published

    Discovery of singlet diradicals: Theoretical study on the cage species C14N12-H6 and its six derivatives

    Zhou, H., Wong, N., Lau, K., Tian, A. & Li, W., 4 Oct 2007, In: Journal of Physical Chemistry A. 111, 39, p. 9838-9847

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 7
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  19. Heterogeneous reactions of linoleic acid and linolenic acid particles with ozone: Reaction pathways and changes in particle mass, hygroscopicity, and morphology

    Lee, A. K. Y. & Chan, C. K., 19 Jul 2007, In: Journal of Physical Chemistry A. 111, 28, p. 6285-6295

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 41
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  20. Published

    Photodissociation pathways of 1,1-dichloroacetone

    Krisch, M. J., Bell, M. J., FitzPatrick, B. L., McCunn, L. R., Lau, K., Liu, Y. & Butler, L. J., 12 Jul 2007, In: Journal of Physical Chemistry A. 111, 27, p. 5968-5980

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 6
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  21. Published

    Possible gas-phase reactions of H2CH4/ tetramethylsilane in diamond/β-SiC nanocomposite film deposition: An ab-initio study

    Zhao, Y. L., Zhang, R. Q., Srikanth, V. V. S. S. & Jiang, X., 10 May 2007, In: Journal of Physical Chemistry A. 111, 18, p. 3554-3559

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 13
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  22. Published

    Characterization of the methoxy carbonyl radical formed via photolysis of methyl chloroformate at 193.3 nm

    Bell, M. J., Lau, K. C., Krisch, M. J., Bennett, D. I. G., Butler, L. J. & Weinhold, F., 15 Mar 2007, In: Journal of Physical Chemistry A. 111, 10, p. 1762-1770

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 10
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  23. 2006
  24. Observation of cysteine thiolate and-S⋯H-O intermolecular hydrogen bond

    Woo, H., Lau, K., Wang, X. & Wang, L., 23 Nov 2006, In: Journal of Physical Chemistry A. 110, 46, p. 12603-12606

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 53
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  25. Lowest-energy structures of water clusters (H 2O)n and (H 2O) 13

    Bulusu, S., Yoo, S., Aprà, E., Xantheas, S. & Zeng, X. C., 26 Oct 2006, In: Journal of Physical Chemistry A. 110, 42, p. 11781-11784

    Research output: Journal Publications and Reviews (RGC: 21, 22, 62)21_Publication in refereed journalpeer-review

    Scopus citations: 84
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