Quantum chemical computational studies on bis-thiourea zinc acetate

[1] Angelimary P.A., Dhanuskodi S., Cryst. Res. Technol., 36 (2001), 1231. http://dx.doi.org/10.1002/1521-4079(200111)36:11<1231::AID-CRAT1231>3.0.CO;2-I10.1002/1521-4079(200111)36:11<1231::AID-CRAT1231>3.0.CO;2-ISearch in Google Scholar

[2] Ushashree P.M., Muralidharan R., Jayavel R., Ramasamy P., J. Cryst. Growth, 218 (2000), 365. http://dx.doi.org/10.1016/S0022-0248(00)00593-510.1016/S0022-0248(00)00593-5Search in Google Scholar

[3] Ushashree P.M., Jayavel R., Subramanian C., Ramasamy P., J. Cryst. Growth, 197 (1999), 216. http://dx.doi.org/10.1016/S0022-0248(98)00906-310.1016/S0022-0248(98)00906-3Search in Google Scholar

[4] Venkataramanan V., Maheswaran S., Sherwood J.N., Bhat H.L., J. Cryst. Growth, 179 (1997), 605. http://dx.doi.org/10.1016/S0022-0248(97)00137-110.1016/S0022-0248(97)00137-1Search in Google Scholar

[5] Rajasekaran R., Ushashree P.M., Jayavel R., Ramasamy P., J. Cryst. Growth, 229 (2001), 563. http://dx.doi.org/10.1016/S0022-0248(01)01229-510.1016/S0022-0248(01)01229-5Search in Google Scholar

[6] Rajasekaran R., Kumar R.M., Jayavel R., Ramasamy P., J. Cryst. Growth, 252 (2003), 317. http://dx.doi.org/10.1016/S0022-0248(02)02467-310.1016/S0022-0248(02)02467-3Search in Google Scholar

[7] Jayalakshmi D., Sankar R., Jayavel R., Kumar J., J. Cryst. Growth, 276 (2005), 243. http://dx.doi.org/10.1016/j.jcrysgro.2004.11.32410.1016/j.jcrysgro.2004.11.324Search in Google Scholar

[8] Jayalakshmi D., Kumar J., Cryst. Res. Technol., 41 (2006), 37. http://dx.doi.org/10.1002/crat.20041052610.1002/crat.200410526Search in Google Scholar

[9] Avci D., Basoğlu A. Atalay Y., Int. J. Quant. Chem. 111 (2011), 147. http://dx.doi.org/10.1002/qua.2241610.1002/qua.22416Search in Google Scholar

[10] Avci D., Spectrochim Acta A 82 (2011), 37. http://dx.doi.org/10.1016/j.saa.2011.06.03710.1016/j.saa.2011.06.037Search in Google Scholar

[11] Pir H., Günay N., Avci D., Atalay Y., Spectrochim Acta A, 96 (2012), 916. http://dx.doi.org/10.1016/j.saa.2012.07.04410.1016/j.saa.2012.07.04422954808Search in Google Scholar

[12] Tamer Ö., Sariboğa B., Uçar İ., Büyükgüngör O, Spectrochim Acta A, 84 (2011), 168. http://dx.doi.org/10.1016/j.saa.2011.09.02510.1016/j.saa.2011.09.02521978558Search in Google Scholar

[13] Tamer Ö., Sariboğa B., Uçar İ., Struct. Chem., 23 (2012), 659. http://dx.doi.org/10.1007/s11224-011-9910-010.1007/s11224-011-9910-0Search in Google Scholar

[14] Atalay Y., Basoglu A., Avci, D., Spectrochim. Acta A 69 (2008), 460. http://dx.doi.org/10.1016/j.saa.2007.04.02210.1016/j.saa.2007.04.02217540615Search in Google Scholar

[15] Jayalakshmi D., Kesavamoorthy R., Thangavel R., Kumar J., Physica B, 371 (2006), 1. http://dx.doi.org/10.1016/j.physb.2005.08.04010.1016/j.physb.2005.08.040Search in Google Scholar

[16] Becke A.D., J. Chem. Phys., 98 (1993), 5648. http://dx.doi.org/10.1063/1.46491310.1063/1.464913Search in Google Scholar

[17] Lee C., Yang W., Parr R.G., Phys. Rev. B 37 (1988), 785. http://dx.doi.org/10.1103/PhysRevB.37.78510.1103/PhysRevB.37.785Search in Google Scholar

[18] Gaussian 09, Revision A.1, Frisch M.J. et al., Gaussian, Inc., Wallingford CT, (2009). Search in Google Scholar

[19] GaussView, Version 5, Dennington R., Keith T., Millam J., Semichem Inc., Shawnee Mission KS, (2009). Search in Google Scholar

[20] Sundaraganesan N., Ilakiamani S., Saleem H., Wojciechowski P.M., Michalska D., Spectrochim. Acta A, 61 (2005), 2995. http://dx.doi.org/10.1016/j.saa.2004.11.01610.1016/j.saa.2004.11.01616165042Search in Google Scholar

[21] Reed A.E., Curtiss L.A., Weinhold F., Chem. Rew., 88 (1988), 899. http://dx.doi.org/10.1021/cr00088a00510.1021/cr00088a005Search in Google Scholar

[22] Chocholousova J., Spirko V.V., Hobza P., Phys. Chem. Chem.Phys., 6 (2004), 37. http://dx.doi.org/10.1039/b314148a10.1039/B314148ASearch in Google Scholar

[23] Zhang C.R., Chem H.S., Wang G.H., Chem. Res. Chin. Uni., 20 (2004), 640. Search in Google Scholar

[24] Kumar P.S., Spectrochim. Acta A, 77 (2010), 45. http://dx.doi.org/10.1016/j.saa.2010.04.02110.1016/j.saa.2010.04.021Search in Google Scholar

[25] Buckingham A.D., Chem. Phys., 12 (1967), 107. 10.1037/009059Search in Google Scholar

[26] Christiansen O., Gauss J., Stanton J. F., Chem. Phys. Lett., 305 (1999), 147. http://dx.doi.org/10.1016/S0009-2614(99)00358-910.1016/S0009-2614(99)00358-9Search in Google Scholar

[27] Bloembergen N., Nonlinear optics, Benjamin, New York, 1965. Search in Google Scholar

[28] Lane N.F., Rev. Mod. Phys., 52 (1980), 29. http://dx.doi.org/10.1103/RevModPhys.52.2910.1103/RevModPhys.52.29Search in Google Scholar

[29] Birnbaum G., Phenomena Induced by Intermolecular Interactions, Plenum, New York, 1980. Search in Google Scholar

[30] Maroulis G., J. Chem. Phys. 113 (2000), 5. http://dx.doi.org/10.1063/1.48198510.1063/1.481985Search in Google Scholar

[31] Avci D., Cömert H., Atalay Y., J. Mol. Mod., 14 (2008), 161. http://dx.doi.org/10.1007/s00894-007-0258-810.1007/s00894-007-0258-818175157Search in Google Scholar

[32] Atalay Y., Avci D., Başoğlu A., Struct. Chem., 19 (2008), 239. http://dx.doi.org/10.1007/s11224-007-9278-310.1007/s11224-007-9278-3Search in Google Scholar

[33] Fukui K., Science 218 (1982), 747. http://dx.doi.org/10.1126/science.218.4574.74710.1126/science.218.4574.74717771019Search in Google Scholar

[34] Pearson R.G., Proceeding of the National Academiy of Sciences, 83 (1986), 8440 http://dx.doi.org/10.1073/pnas.83.22.844010.1073/pnas.83.22.844038694516578791Search in Google Scholar

[35] Avci D., Atalay Y., Cömert H., Dinçer M., Arab. J. Sci. Eng. 36 (2011) 607. http://dx.doi.org/10.1007/s13369-011-0059-310.1007/s13369-011-0059-3Search in Google Scholar

[36] Mulliken R.S., J. Chem. Phys. 23 (1955), 1833. http://dx.doi.org/10.1063/1.174058810.1063/1.1740588Search in Google Scholar

[37] Mukherjee V., Singh N.P., Yadav R.A., Spectrochim. Acta A, 73 (2009), 249. http://dx.doi.org/10.1016/j.saa.2009.02.01410.1016/j.saa.2009.02.01419303353Search in Google Scholar