Journal of Physical Chemistry A

Journal of Physical Chemistry A

ISSNs: 1089-5639, 1520-5215

American Chemical Society, United States

Scopus rating (2021): CiteScore 4.6 SJR 0.656 SNIP 0.863

Journal

Journal Metrics
1 - 20 out of 77Page size: 20

Research Output

  1. 2020

  2. Influence of Torsional Anharmonicity on the Reactions of Methyl Butanoate with Hydroperoxyl Radical

    Meng, Q., Zhang, L., Chen, Q., Chi, Y. & Zhang, P., 22 Oct 2020, In: Journal of Physical Chemistry A. 124, 42, p. 8643-8652

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

    Scopus citations: 5
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  3. 2018

  4. Toward High-Level Theoretical Studies of Large Biodiesel Molecules: An ONIOM [QCISD(T)/CBS: DFT] Study of the Reactions between Unsaturated Methyl Esters (CnH2 n -1COOCH3) and Hydrogen Radical

    Zhang, L., Meng, Q., Chi, Y. & Zhang, P., 31 May 2018, In: Journal of Physical Chemistry A. 122, 21, p. 4882-4893

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

    Scopus citations: 14
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  5. 2017

  6. Structural Evolution of Gold Clusters Aun- (n = 21-25) Revisited

    Khetrapal, N. S., Bulusu, S. S. & Zeng, X. C., 30 Mar 2017, In: Journal of Physical Chemistry A. 121, 12, p. 2466-2474

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

    Scopus citations: 18
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  7. 2016

  8. Theoretical Study on Charge Transport Properties of Intra- and Extra-Ring Substituted Pentacene Derivatives

    Fan, J., Chen, X., Zhang, S. & Ren, A., 2 May 2016, In: Journal of Physical Chemistry A. 120, 15, p. 2390-2400

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

    Scopus citations: 17
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  9. 2015

  10. Stability of Metal-Encapsulating Boron Fullerene B40

    Fa, W., Chen, S., Pande, S. & Zeng, X. C., 20 Oct 2015, In: Journal of Physical Chemistry A. 119, 45, p. 11208-11214

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

    Scopus citations: 65
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  11. Nonresonant energy transfers independent on the phonon densities in polyatomic liquids

    Chen, H., Zhang, Q., Guo, X., Wen, X., Li, J., Zhuang, W. & Zheng, J., 29 Jan 2015, In: Journal of Physical Chemistry A. 119, 4, p. 669-680

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

    Scopus citations: 9
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  12. 2014

  13. Hydrogen-Bonding Interactions in Hard Segments of Shape Memory Polyurethane: Toluene Diisocyanates and 1,6-Hexamethylene Diisocyanate. A Theoretical and Comparative Study

    Zhang, C., Hu, J., Li, X., Wu, Y. & Han, J., 26 Dec 2014, In: Journal of Physical Chemistry A. 118, 51, p. 12241-12255

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

    Scopus citations: 33
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  14. Isomeric product detection in the heterogeneous reaction of hydroxyl radicals with aerosol composed of branched and linear unsaturated organic molecules

    Nah, T., Zhang, H., Worton, D. R., Ruehl, C. R., Kirk, B. B., Goldstein, A. H., Leone, S. R., & 1 othersWilson, K. R., 11 Dec 2014, In: Journal of Physical Chemistry A. 118, 49, p. 11555-11571

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

    Scopus citations: 13
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  15. Influence of molecular structure and chemical functionality on the heterogeneous OH-initiated oxidation of unsaturated organic particles

    Nah, T., Kessler, S. H., Daumit, K. E., Kroll, J. H., Leone, S. R. & Wilson, K. R., 12 Jun 2014, In: Journal of Physical Chemistry A. 118, 23, p. 4106-4119

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

    Scopus citations: 24
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  16. Molecular distances determined with resonant vibrational energy transfers

    Chen, H., Wen, X., Li, J. & Zheng, J., 3 Apr 2014, In: Journal of Physical Chemistry A. 118, 13, p. 2463-2469

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

    Scopus citations: 23
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  17. 2013

  18. OH-initiated heterogeneous oxidation of cholestane: A model system for understanding the photochemical aging of cyclic alkane aerosols

    Zhang, H., Ruehl, C. R., Chan, A. W. H., Nah, T., Worton, D. R., Isaacman, G., Goldstein, A. H., & 1 othersWilson, K. R., 27 Nov 2013, In: Journal of Physical Chemistry A. 117, 47, p. 12449-12458

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

    Scopus citations: 19
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  19. Relative intermolecular orientation probed via molecular heat transport

    Chen, H., Bian, H., Li, J., Wen, X. & Zheng, J., 25 Jul 2013, In: Journal of Physical Chemistry A. 117, 29, p. 6052-6065

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

    Scopus citations: 18
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  20. The influence of molecular structure and aerosol phase on the heterogeneous oxidation of normal and branched alkanes by OH

    Ruehl, C. R., Nah, T., Isaacman, G., Worton, D. R., Chan, A. W. H., Kolesar, K. R., Cappa, C. D., & 2 othersGoldstein, A. H. & Wilson, K. R., 16 May 2013, In: Journal of Physical Chemistry A. 117, 19, p. 3990-4000

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

    Scopus citations: 45
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  21. Ab initio kinetics for the decomposition of hydroxybutyl and butoxy radicals of n-butanol

    Zhang, P., Klippenstein, S. J. & Law, C. K., 7 Mar 2013, In: Journal of Physical Chemistry A. 117, 9, p. 1890-1906

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

    Scopus citations: 42
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  22. 2012

  23. Ab initio kinetics for thermal decomposition of CH 3N• NH 2, cis-CH 2NHN•H, trans-CH 3NHN•H, and C•H 2NNH 2 radicals

    Sun, H., Zhang, P. & Law, C. K., 23 Aug 2012, In: Journal of Physical Chemistry A. 116, 33, p. 8419-8430

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

    Scopus citations: 8
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  24. OH-initiated heterogeneous aging of highly oxidized organic aerosol

    Kessler, S. H., Nah, T., Daumit, K. E., Smith, J. D., Leone, S. R., Kolb, C. E., Worsnop, D. R., & 2 othersWilson, K. R. & Kroll, J. H., 21 Jun 2012, In: Journal of Physical Chemistry A. 116, 24, p. 6358-6365

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

    Scopus citations: 48
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  25. Gas-phase kinetics study of reaction of OH radical with CH 3NHNH 2 by second-order multireference perturbation theory

    Sun, H., Zhang, P. & Law, C. K., 31 May 2012, In: Journal of Physical Chemistry A. 116, 21, p. 5045-5056

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

    Scopus citations: 10
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  26. The empirical correlation between hydrogen bonding strength and excited-state intramolecular proton transfer in 2-pyridyl pyrazoles

    Lin, T., Tang, K., Yang, S., Shen, J., Cheng, Y., Pan, H., Chi, Y., & 1 othersChou, P., 10 May 2012, In: Journal of Physical Chemistry A. 116, 18, p. 4438-4444

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

    Scopus citations: 54
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  27. 2011

  28. Nonresonant and resonant mode-specific intermolecular vibrational energy transfers in electrolyte aqueous solutions

    Bian, H., Chen, H., Li, J., Wen, X. & Zheng, J., 27 Oct 2011, In: Journal of Physical Chemistry A. 115, 42, p. 11657-11664

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

    Scopus citations: 50
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  29. Which DFT functional performs well in the calculation of methylcobalamin? Comparison of the B3LYP and BP86 functionals and evaluation of the impact of empirical dispersion correction

    Hirao, H., 25 Aug 2011, In: Journal of Physical Chemistry A. 115, 33, p. 9308-9313

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

    Scopus citations: 77
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