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Collect. Czech. Chem. Commun. 1987, 52, 2831-2838

C60(g), C70(g), saturated carbon vapour and increase of cluster populations with temperature: A combined AM1 quantum-chemical and statistical-mechanical study

Zdeněk Slaninaa,b, Jerzy M. Rudzińskic,d and Eiji Ōsawac

a Centro del C.N.R. per lo Studio delle Relazioni tra Struttura e Reattivitá Chimica, c/o Dipartimento di Chimica Fisica ed Elettrochimica, Universitá di Milano, I-20133 Milano, Italy
b The J. Heyrovský Institute of Physical Chemistry and Electrochemistry, Czechoslovak Academy of Sciences, 121 38 Prague 2, Czechoslovakia
c Department of Chemistry, Faculty of Science, Hokkaido University, J-060 Sapporo, Japan
d Institute of Chemistry, University of Wrocław, P-50 383 Wrocław, Poland

Crossref Cited-by Linking

  • Lal Bhajan: Computational study of enantioselective interaction between C60 fullerene and its derivatives with L-histidine. J Mol Model 2007, 13, 531. <>
  • Slanina Zdeněk, Uhlík Filip, Lee Shyi-Long, Adamowicz Ludwik, Nagase Shigeru: Computations of production yields for Ba@C74 and Yb@C74. Mol Simul 2007, 33, 563. <>
  • Slanina Z., Zhao X., Uhlík F., Lee S.-L., Adamowicz L.: Computing enthalpy-entropy interplay for isomeric fullerenes. Int. J. Quantum Chem. 2004, 99, 640. <>
  • Slanina Zdenêk: Clustering, Saturated Vapors, and the Atmosphere. Jnl Chinese Chemical Soc 2003, 50, 607. <>
  • Chen Cheng, Liu Min-Hsien, Wu Lung-Shing, Slanina Zden��k, Zhao Xiang, Uhl����k Filip, Lee Shyi-Long, Park Won Kyu, Park Seung C.: Local analysis and comparative study of the hydrogen bonds in the linear (HCN)n and (HNC)n clusters. Journal of Molecular Structure: THEOCHEM 2003, 630, 187. <>
  • Bonnet Pascal, Beà Ivan, Jaime Carlos, Morin-Allory Luc: Molecular Modelling Study of the 2:1 γ-Cyclodextrin:C60 Complex. Dummy Atoms Simulating Bond Electron Distribution. Supramolecular Chemistry 2003, 15, 251. <>
  • Slanina Zdeněk: Clusters in a Saturated Vapor: Pressure-Based Temperature Enhancement of the Cluster Fraction. Zeitschrift für Physikalische Chemie 2003, 217, 1119. <>
  • Slanina Zdeněk, Zhao Xiang, Kurita Noriyuki, Gotoh Hitoshi, Uhlı́k Filip, Rudziński Jerzy M, Lee Kee Hag, Adamowicz Ludwik: Computing the relative gas-phase populations of C60 and C70: beyond the traditional δHf,298o scale. Mol Graph Model 2001, 19, 216. <>
  • Sokolov Vyacheslav I, Stankevich Ivan V: The fullerenes — new allotropic forms of carbon: molecular and electronic structure, and chemical properties. Russ. Chem. Rev. 1993, 62, 419. <>
  • The evolution of the football structure for the C 60 molecule: a retrospective. Phil. Trans. R. Soc. Lond. A 1993, 343, 1. <>
  • Rosén Arne, Wästberg Bo: Buckminsterfullerene C60 — a surface with curvature and interesting properties. Surface Science 1992, 269-270, 1121. <>
  • Cyvin B.N., Brendsdal E., Brunvoll J., Cyvin S.J.: Condensed aromatics—XXVI. Vibrational frequencies of 13C60 isotopic buckminsterfullerene. Spectrochimica Acta Part A: Molecular Spectroscopy 1992, 48, 1355. <>
  • Brendsdal E., Brunvoll J., Cyvin B. N., Cyvin S. J.: Mean Amplitudes of Vibration and Related Quantities for Buckminsterfullerene. Spectroscopy Letters 1992, 25, 911. <>
  • Wästberg Bo, Rosén Arne: Electronic structure of C60and the alkali atom containing compounds MC60, M = Li, Na, K, Rb, Cs and K2C60. Phys. Scr. 1991, 44, 276. <>
  • Fujita Shinsaku: Soccerane Derivatives of Given Symmetries. BCSJ 1991, 64, 3215. <>
  • Slanina Zdeněk, Rudziński Jerzy M., Togasi Masatomo, Ōsawa Eoji: On relative stability reasoning for clusters of different dimensions: an illustration with the C60-C70 system. Thermochimica Acta 1989, 140, 87. <>
  • Slanina Zden��k: Some aspects of mathematical chemistry of equilibrium and rate processes: steps towards a completely non-empirical computer design of syntheses. Journal of Molecular Structure: THEOCHEM 1989, 185, 217. <>
  • Slanina Zden��k, Rudzi��ski Jerzy M., Togasi Masatomo, ��sawa Eiji: Quantum-chemically supported vibrational analysis of giant molecules: the C60 and C70 clusters. Journal of Molecular Structure: THEOCHEM 1989, 202, 169. <>