Browsing Fizik / Physics by Author "Gumus, HP; Tamer, O; Avci, D; Tarcan, E; Atalay, Y"

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Theoretical Investigations on Nonlinear Optical and Spectroscopic Properties of 6-(3,3,4,4,4-Pentafluoro-2-hydroxy-1-butenyl)-2,4-pyrimidinedione: An Efficient NLO Material

Tamer, Ömer; Avcı, Davut; Atalay, Yusuf (MAIK NAUKA/INTERPERIODICA/SPRINGER, 2014)

In this study, quantum chemical calculations of geometric parameters, conformational, natural bond orbital (NBO) and nonlinear optical (NLO) properties, vibrational frequencies, H-1 and C-13 NMR chemical shifts of the title ...