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[1] Noyes, A. A.; Sherrill, M. S., A Course of Study in Chemical Principles, New York: Macmillan, 1st ed. in 1922, 2nd ed. in 1938.
[2] Adamson, A.W., Understanding Physical Chemistry, Benjamin, 1964; Addison Wesley, 1969¡£ÖÐÒë±¾£º¹ùÇàËɵÈÒ룬¡¶ÎïÀí»¯Ñ§¾«Îö¡·£¬ÄÚÃɹÅÈËÃñ³ö°æÉ磬1987Äê¡£
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[3] Callen, H. B., Thermodynamics and An Introduction to Thermostatistics, 2nd. Ed., John Wiley & Sons, New York, 1985.
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[4] Parr R G, Yang W. Density-Functional Theory of Atoms and Molecules. New York: Oxford University Press, 1989.
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[5] ÌÆÓÐì÷£¬¡¶Í³¼ÆÁ¦Ñ§£º¼°ÆäÔÚÎïÀí»¯Ñ§ÖеÄÓ¦Óá·£¬¿Æѧ³ö°æÉ磬±±¾©£¬1964Äê¡£
[6] Hill, T. L., Introduction to Statistical Thermodynamics, Addison-Wesley Pub Co., 1960.
[7] McQuarrie A D. Statistical Mechanics. New York: Harper & Row, 1976.
[8] Chandler D. Introduction to Modern Statistical Mechanics. New York: Oxford University Press, 1987.
[9] Zwanzig, R., Nonequilibrium Statistical Mechanics, Oxford University Press, 2001.
[10] Wilde R E, Singh S. Statistical Mechanics: Fundamentals and Modern Applications. New York: John Wiley & Sons, 1998.
[11] Widom B. Statistical Mechanics: A Concise Introduction for Chemists. New York: Cambridge University Press, 2002.
[12] Tuckerman M E. Statistical Mechanics: Theory and Molecular Simulation. New York: Oxford University Press, 2010.
[13] Hynes, J. T., Deutch, J. M., Nonequilibrium Problems: Projection Operator Techniques, in Physical Chemistry, an Advanced Treatise, Vol. 11B, ( ed. by D. Henderson ), Academic Press, New York, 1975, Ch.11.
[14] ³ÂÃô²®£¬¡¶Í³¼ÆÁ¦Ñ§£ºÀíÂÛ»¯Ñ§ÓÃÊé¡·£¬±±¾©£º¿Æѧ³ö°æÉ磬2012Äê¡£
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[15] Wilson E B Jr., Decius J C, Cross P C. Molecular Vibrations, the Theory of Infrared and Raman Vibrational Spectra. New York: McGraw Hill, 1955£»ÖÐÒë±¾£º¡¶·Ö×ÓÕñ¶¯£ººìÍâºÍÀÂüÕñ¶¯¹âÆ×ÀíÂÛ¡·£¬¿Æѧ³ö°æÉ磬1985Äê¡£
[16] Mukamel S., Principles of Nonlinear Optical Spectroscopy, Oxford University Press, New York, 1995.
[17] ÁºÓ³ÇÕÔÎÄÔË£¬¡¶·Ö×ÓÕñ¶¯ºÍÕñ¶¯¹âÆס·£¬±±¾©´óѧ³ö°æÉ磬1990Äê¡£
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[18] Hansen, J. -P., McDonald, I. R., Theory of Simple Liquids, 3rd. ed., Elsevier (USA), 2006.
[19] Evans, D. J., Morriss, G. P., Statistical Mechanics of Nonequilibrium Liquids, 2nd ed. London: Academic Press, 2008.
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¡¾ºË´Å¹²ÕñÀíÂÛµÄÊ飬µ±È»Ê×ÍÆR. ErnstµÄÊé¡°Principles of Nuclear Magnetic Resonance in One and Two Dimensions¡±£¨Ò²ÓÐÖÐÒë±¾£©£¬µ«ÊÇÄÇÊéÌ«ºñ¡£ÎÒÍƼö¿´»ª¶«Ê¦·¶´óѧ»ÆÓÀÈʽÌÊÚµÄÊ顶ºË´Å¹²ÕñÀíÂÛÔÀí¡·[20]¡£»ª¶«Ê¦·¶´óѧ´ÓÀÏÒ»±²Ö£Ò»ÉÆÏÈÉú¿ªÊ¼·Ö×Ó¹âÆ×ÊÇÈ«¹úµÄÇ¿Ïî¡£80Äê´ú»ÆÓÀÈʽÌÊÚÖ±½ÓÊÜÒµÓÚErnestѧÅÉ£¬¿´´ËÊéÈçͬ¿´ErnstµÄÊé¡£¶ÔÓÚ»¯Ñ§¼Ò£¬Ó¦¸Ã×¢Ò⣺Èô²»Ñ§¶®Öм¶Ë®Æ½µÄÁ¿×ÓÁ¦Ñ§£¬ÔòÎÞÂÛ¿´Ê²Ã´NMRÊ飬¶¼Ö»ÄÜÍ£ÁôÔÚ²Ù×÷ÒÇÆ÷µÄˮƽ¡£¡¿
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[21] Eyring, H£¬Lin, S. H., Lin, S. M., Basic Chemical Kinetics£¬John Wiley & Sons£¬1980£¬ÖÐÒë±¾£º¡¶»ù´¡»¯Ñ§¶¯Á¦Ñ§¡·£¬Íõ×÷У¬ÅËÇ¿ÓàÒ룬±±¾©£º¿Æѧ³ö°æÉ磬1984Äê¡£
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[23] ½ð¼Ò¿¥£¬¡¶·Ö×Ó»¯Ñ§·´Ó¦¶¯Ì¬Ñ§¡·£¬ÉϺ£½»Í¨´óѧ³ö°æÉ磬1989Äê¡£
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[25] Henriksen N.E., Hansen F.Y., Theories of Molecular Reaction Dynamics, New York: Oxford University Press, 2008.
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