References
Gyul’maliev, A.M., Golovin, G.S., and Gladun, T.G., Teoreticheskie osnovy khimii uglya (Theoretical Principles of Coal Chemistry), Moscow: Izd. Mosk. Gos. Gorn. Univ., 2003.
Bubnovskaya, L.M., Rus’yanova, N.D., Popov, V.K., et al., Comparison of Spectral Parameters with the Technological Characteristics of Coal, Koks Khim., 1988, no. 8, pp. 15–17.
Sentfle, J.T., Kuehn, D., Davis, A., et al., Fuel, 1984, vol. 63, no. 2, pp. 245–250.
Popov, V.K., Butakova, V.I., Posokhov, Yu.M., et al., Express Analysis of Coal Quality on the Basis of Diffuse-Reflection IR Spectroscopy, Koks Khim., 2005, no. 3, pp. 2–4.
Korolev, Yu.M., Gagarin, S.G., Friesen, V.I., and Mikazlan, K.G., X-ray Diffusion and IR Spectroscopic Study of Coal of Low Metamorphic Levels, Koks Khim., 1997, no. 12, pp. 2–8.
Vassallo, A.M., Lockhart, N.C., Hanna, J.V., et al., Energ. Fuels, 1991, vol. 5, no. 3, pp. 477–482.
Friesen, W.I. and Michaelian, K.N., Appl. Spectrosc., 1991, vol. 45, no. 1, pp. 50–56.
Popov, V.K., Butakova, V.I., Posokhov, Yu.M., and Galakhov, A.V., Using IR Spectroscopy to Study a Structural Fragment of Coal Associated with Its Sintering Properties, Koks Khim., 2005, no. 2, pp. 4–7.
Bellamy, L.J., Infrared Spectra of Complex Molecules, New York: John Wiley, 1958.
Nakanishi, K., IR Spectra and Structure of Organic Compounds (Russian translation), Moscow: Mir, 1965.
Gyul’maliev, A.M., Gagarin, S.G., and Golovin, G.S., Structure and Properties of the Organic Mass of Coal, Khim. Tverd. Topl., 2004, no. 6, pp. 10–31.
Gagarin, S.G., Simulation of the Molecular Structure of Coal Products, Koks Khim., 2004, no. 8, pp. 22–25.
Gribov, L.A., Vvedenie v teoriyu i raschet kolebatel’nykh spektrov mnogoatomnykh molekul (Introduction to the Theory and Calculation of Oscillatory Spectra of Multiatomic Molecules), Leningrad: Izd. LGU, 1965.
Koptev, G.S. and Pentin, Yu.A., Raschet kolebanii molekul (Calculation of Molecular Oscillations), Moscow: Izd. MGU, 1977.
Stewart, J.J.P., J. Computer-Aided Mol. Des., 1990, vol. 4, no. 1, pp. 1–14.
Gagarin, S.G., Epshtein, S.A., and Barabanova, O.V., Desorption Kinetics of Dimethylformamide from Coal with Different Degrees of Reduction, Khim. Tverd. Topl., 2005, no. 3, pp. 10–21.
Sevast’yanov, D.S., Gyul’maliev, A.M., and Gagarin, S.G., Simulation of the Structure and Properties of Coal Adsorbents, Khim. Tverd. Topl., 2006, no. 5, pp. 40–49.
Gagarin, S.G. and Gyul’maliev, A.M., Analysis of Data on the Heat of Vaporization of Methyl-Substituted Phenol Derivatives, Koks Khim., 2007, no. 8, pp. 34–38.
Curran, H., Wu. C., Marinov, N., et al., J. Phys. Chem. Ref. Data, 2000, vol. 29, no. 3, pp. 463–517.
Hertzberg, G., Molecular Spectra and Molecular Structure, Vol. II, Infrared and Raman Spectra of Polyatomic Molecules, New York: Van Nostrand, 1945.
Bakhshiev, N.G., Vvedenie v molekulyarnuyu spektroskopiyu (Introduction to Molecular Spectroscopy), Leningrad: Izd. LGU, 1974.
Gagarin, S.G. and Gladun, T.G., Estimating the Enthalpy of Formation of the Organic Mass of Coal and Anthracite, Khim. Tverd. Topl., 2003, no. 4, pp. 3–23.
Gagarin, S.G. and Maloletnev, A.S., Composition and Properties of Coal Distillates and Their Hydration Products, Khim. Tverd. Topl., 2005, no. 2, pp. 16–31.
Genetti, D.B., Fletcher, T.H., and Pugmire, R.J., Coal Science and Technology: Proc. Eighth International Conference on Coal Science, Amsterdam: Elsevier, 1995, vol. 1, pp. 331–334.
Popov, V.K., Bubnovskaya, L.M., and Mochalov, V.V., Structural Characteristics of Coal. 5. Refining the Assignment of IR Spectral Bands, Koks Khim., 1987, no. 4, pp. 11–14.
Michaelian, K.H., Ogunsola, O.I., and Bartholomew, R.J., Canad. J. Appl. Spectrosc., 1993, vol. 38, no. 3, pp. 70–77.
Chen, P., Yang, P.W.-J., and Griffiths, P.R., Fuel, 1985, vol. 64, no. 3, pp. 307–312.
Guiliano, M., Mille, G., Doumenq, P., et al., Advanced Methodology of Coal Characterization, Amsterdam: Elsevier, 1990, pp. 399–417.
Dyrkacz, G.R., Bloomquist, C.A.A., and Ruscic, L., Energ. Fuels, 1991, vol. 5, no. 1, pp. 155–163.
Mastalerz, M., Bustin, R.M., and Lamberson, M.N., Intern. J. Coal Geol., 1993, vol. 22, no. 2, pp. 149–162.
Dent, R. and Brown, J.K., Fuel, 1961, vol. 40, no. 1, pp. 47–56.
Painter, P.C., Starsinic, M., Squires, E., and Davis, A.A., Fuel, 1983, vol. 62, no. 6, pp. 742–744.
Solomon, P.R. and Carangelo, R.M., Fuel, 1988, vol. 67, no. 7, pp. 949–959.
Supaluknari, S., Larkins, F.P., Redlich, P., and Jackson, W.R., Fuel Proc. Technol., 1988, vol. 18, pp. 147–160.
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Original Russian Text © S.G. Gagarin, A.M. Gyul’maliev, 2007, published in Koks i Khimiya, 2007, No. 10, pp. 2–12.
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Gagarin, S.G., Gyul’maliev, A.M. Simulation of the IR spectra of the organic mass of coal and coal products. Coke Chem. 50, 275–284 (2007). https://doi.org/10.3103/S1068364X07100018
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DOI: https://doi.org/10.3103/S1068364X07100018