Chemical Department, Eastern European University, Al. Voli 6, Lutsk, Ukraine.
Spectrochim Acta A Mol Biomol Spectrosc. 2013 Dec;116:446-50. doi: 10.1016/j.saa.2013.07.042. Epub 2013 Aug 8.
The novel crystalline alloys CdTe-CuInTe2 were synthesized. The photoinduced spectral changes of the anharmonic phonon modes were explored by cw CO2 laser at power about 2 kW in the vicinity of the 1650 cm(-1) mode. The changes of the intensities for principal phonon modes were found. These modes were assigned both to harmonic as well as anharmonic modes. All the measurements are studied after the Ir illumination. The performed quantum chemical calculations with application of the norm-conserving pseudopotential method and Green functions allow to identify the origin of the content dependent anharmonic phonon modes. Some correlation between the intensities of the corresponding phonon modes at about 1600-1700 cm(-1) and the corresponding IR induced changes were found.
新型晶态合金 CdTe-CuInTe2 被合成。在 1650cm(-1) 附近,通过 CW CO2 激光(功率约 2kW)探索了非谐声子模式的光致光谱变化。发现了主要声子模式强度的变化。这些模式既可以是谐和模式,也可以是非谐和模式。所有测量都是在 Ir 照射后进行的。应用保形赝势方法和格林函数进行的量子化学计算允许识别与内容相关的非谐声子模式的起源。在约 1600-1700cm(-1)处,发现了相应声子模式的强度与相应的 IR 诱导变化之间的某些相关性。