Journal of Chemical Physics

Journal of Chemical Physics

ISSNs: 0021-9606

Additional searchable ISSN (electronic): 1089-7690

AMER INST PHYSICS, United States

Scopus rating (2023): CiteScore 7.4 SJR 1.101 SNIP 1.196

Journal

Journal Metrics
61 - 80 out of 206Page size: 20

Research Output

  1. 2009

  2. First-principles study of methane dehydrogenation on a bimetallic Cu/Ni(111) surface

    An, W., Zeng, X. C. & Turner, C. H., 2009, In: Journal of Chemical Physics. 131, 17, 174702.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 101
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  3. On the phase diagram of water with density functional theory potentials: The melting temperature of ice Ih with the Perdew-Burke-Ernzerhof and Becke-Lee-Yang-Parr functionals

    Yoo, S., Zeng, X. C. & Xantheas, S. S., 2009, In: Journal of Chemical Physics. 130, 22, 221102.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 215
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  4. Published

    Stacking of polycyclic aromatic hydrocarbons as prototype for graphene multilayers, studied using density functional theory augmented with a dispersion term

    Feng, C., Lin, C. S., Fan, W., Zhang, R. Q. & Van Hove, M. A., 2009, In: Journal of Chemical Physics. 131, 19, 194702.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 51
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  5. Tuning the electronic properties of the golden buckyball by endohedral doping: M@Au16 - (M=Ag,Zn,In)

    Wang, L.-M., Pal, R., Huang, W., Zeng, X. C. & Wang, L.-S., 2009, In: Journal of Chemical Physics. 130, 5, 051101.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 63
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  6. 2008

  7. Ab initio calculation of carbon clusters. II. Relative stabilities of fullerene and nonfullerene C24

    An, W., Shao, N., Bulusu, S. & Zeng, X. C., 2008, In: Journal of Chemical Physics. 128, 8, 084301.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 58
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  8. Adaptive minimum action method for the study of rare events

    Zhou, X., Ren, W. & Weinan, E., 2008, In: Journal of Chemical Physics. 128, 10, 104111.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 83
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  9. Electronic and magnetic properties of endohedrally doped fullerene Mn@ C60: A total energy study

    Li, G., Sabirianov, R. F., Lu, J., Zeng, X. C. & Mei, W. N., 2008, In: Journal of Chemical Physics. 128, 7, 074304.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 19
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  10. Published

    Energy alignment induced negative differential resistance: The role of hybrid states in aromatic molecular devices

    Fan, W., Zhang, R. Q., Rocha, A. R. & Sanvito, S., 2008, In: Journal of Chemical Physics. 129, 7, 74710.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 19
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  11. Published

    First principles studies for formation mechanism and properties of ethylene molecule adsorbing on diamond (100) surface

    Jin, H., Dai, Y., Long, R., Guo, M., Huang, B. & Zhang, R., 2008, In: Journal of Chemical Physics. 128, 11, 114710.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 4
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  12. Half-metallicity in hybrid BCN nanoribbons

    Kan, E.-J., Wu, X., Li, Z., Zeng, X. C., Yang, J. & Hou, J. G., 2008, In: Journal of Chemical Physics. 129, 8, 084712.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 138
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  13. Published

    Investigation of the O+allyl addition/elimination reaction pathways from the OCH2CHCH2 radical intermediate

    FitzPatrick, B. L., Lau, K.-C., Butler, L. J., Lee, S.-H. & Lin, J.J.-M., 2008, In: Journal of Chemical Physics. 129, 8, 84301.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 20
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  14. Medium-sized double magic metal clusters: Al@Cu54- and Al@Ag54-

    Gao, Y., Shao, N. & Zeng, X. C., 2008, In: Journal of Chemical Physics. 129, 8, 084703.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 5
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  15. Published

    Optimal surface functionalization of silicon quantum dots

    Li, Q. S., Zhang, R. Q., Lee, S. T., Niehaus, T. A. & Frauenheim, T., 2008, In: Journal of Chemical Physics. 128, 24, 244714.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 59
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  16. Probing the electronic and structural properties of doped aluminum clusters: M Al12- (M=Li, Cu, and Au)

    Pal, R., Cui, L.-F., Bulusu, S., Zhai, H.-J., Wang, L.-S. & Zeng, X. C., 2008, In: Journal of Chemical Physics. 128, 2, 024305.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 50
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  17. Rovibrationally selected and resolved pulsed field ionization-photoelectron study of propyne: Ionization energy and spin-orbit interaction in propyne cation

    Xing, X., Bahng, M.-K., Reed, B., Lam, C. S., Lau, K.-C. & Ng, C. Y., 2008, In: Journal of Chemical Physics. 128, 9, 094311.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 25
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  18. Search for lowest-energy structure of Zintl dianion Si12 2-, Ge12 2-, and Sn12 2-

    Shao, N., Bulusu, S. & Zeng, X. C., 2008, In: Journal of Chemical Physics. 128, 15, 154326.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 17
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  19. Published

    Structures and electronic transport of water molecular nanotubes embedded in carbon nanotubes

    Li, H., Zhang, X. Q. & Liew, K. M., 2008, In: Journal of Chemical Physics. 128, 3, 34707.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 17
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  20. Structures and relative stability of medium- and large-sized silicon clusters. VI. Fullerene cage motifs for low-lying clusters Si39, Si40, Si50, Si60, Si70, and Si80

    Yoo, S., Shao, N. & Zeng, X. C., 2008, In: Journal of Chemical Physics. 128, 10, 104316.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 34
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  21. Published

    Synthesis, growth mechanism, and light-emission properties of twisted SiO2 nanobelts and nanosprings

    Zhang, Z. Y., Wu, X. L., Xu, L. L., Shen, J. C., Siu, G. G. & Chu, P. K., 2008, In: Journal of Chemical Physics. 129, 16, 164702.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 15
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  22. Published

    Vacuum ultraviolet pulsed field ionization-photoelectron and infrared-photoinduced Rydberg ionization study of trans-1,3-butadiene

    Hou, Y., Woo, H.-K., Wang, P., Xing, X., Ng, C. Y. & Lau, K.-C., 2008, In: Journal of Chemical Physics. 129, 11, 114305.

    Research output: Journal Publications and Reviews › RGC 21 - Publication in refereed journal › peer-review

    Scopus citations: 4
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