[1] Zhang Xiaojian, Chen Cao, Lin Pengfei, et al.. Emergency drinking water treatment during source water pollution accidents in China: origin analysis, framework and technologies [J]. Environmental Science & Technology, 2011, 45 (1): 161-167.
[2] M Esboui, C Jouvet, C Dedonder, et al.. Excited-state dynamics of the 2-hydroxypyridine ammonia complex [J]. J Phys Chem A, 2010, 114(9): 3060-3066.
[3] Geng Qijin, Guo Qingjie, Cao Changqing, et al.. Alternate cycles process for municipal WWTPs upgrading: ready for widespread application [J]. Industrial & Engineering Chemistry Research, 2008, 47(13): 4363-4368.
[4] A Bankura, A Chandra. A first principles molecular dynamics study of the solvation structure and migration kinetics of an excess proton and a hydroxide ion in binary water-ammonia mixtures [J]. J Chem Phys, 2012, 136(11): 114509.
[5] M N Slipchenko, B G Sartakov, A F Vilesov. Evolution of the vibrational spectrum of ammonia from single molecule to bulk [J]. J Chem Phys, 2008, 128(13): 134509.
[6] S Pratihar, A Chandra. A first principles molecular dynamics study of lithium atom solvation in binary liquid mixture of water and ammonia: structural, electronic, and dynamical properties [J]. J Chem Phys, 2011, 134(2): 024519.
[8] M L Hause, Y H Yoon, F F Crim. Vibrationally mediated photodissociation of ammonia: the influence of N-H stretching vibrations on passage through conical intersections [J]. J Chem Phys, 2006, 125(17): 174309.
[9] A D Becke. Density-functional thermochemistry. III. the role of exact exchange [J]. J Chem Phys, 1993, 98(7): 5648-5652.
[10] J P Perdew. Density-functional approximation for the correlation energy of the inhomogeneous electron gas [J]. Phys Rev B, 1986, 33(12): 8822-8824.
[11] P Hohenerg, W Kohn. Inhomogeneons electron gas [J]. Phys Rev, 1964, 136(3B): B864-B871.
[12] M J Frisch, G W Trucks, H B Schlegel, et al.. Gaussian03, revision C.02 [OL]. http://www.citeulike.org/group/7862/article/3740703. [2014-01-27].
[13] G Herzberg. Molecular Spectra and Molecular Structure Ⅲ: Electronic Spectra and Electronic Structure of Polyatomic Molecules [M]. New York: van Nostrand Reinhold, 1996. 609.
[14] T Shimanouchi. Tables of Molecular Vibrational Frequencies Consolidated Volume I [M]. Washington: National Bureau of Standards, 1972. 1-160.
[15] H Nakatsuji. Cluster expansion of the wavefunction. Electron correlations in ground and excited states by SAC (symmetry-adapted-cluster) and SAC CI theories [J]. Chem Phys Lett, 1979, 67(2-3): 329-333.
[16] T Nakajima, H Nakatsuji. Energy gradient method for the ground, excited, ionized, and electron-attached states calculated by the SAC (symmetry-adapted cluster)/SAC-CI(configuration interaction) method [J]. Chem Phys, 1999, 242(2): 177-193.
[17] Zhu Zhenghe. Atomic and Molecular Reaction Statics [M]. Beijing: Science Press, 2007.
