Remarkable non-linear optical properties of gold cluster doped graphyne (GY): A DFT study.

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第一作者： Alvina,Rasool

第一单位： Department of Chemistry, University of Agriculture, Faisalabad, 38000, Pakistan.

作者： Alvina,Rasool ^[1] ; Saba,Zahid ^[1] ; Nada,Alfryyan ^[2] ; Ali Raza,Ayub ^[1] ; Khurshid,Ayub ^[3] ; Mohammed Salim,Akhter ^[4] ; Javed,Iqbal ^[5] ; M S,Al-Buriahi ^[6] ; El Sayed,Yousef ^[7]

作者单位： Department of Chemistry, University of Agriculture, Faisalabad, 38000, Pakistan. ^[1] Department of Physics, College of Science, Princess Nourah Bint Abdulrahman University, P.O. Box 84428, Riyadh, 11671, Saudi Arabia. ^[2] Department of Chemistry, COMSAT University, Abbottabad Campus, KPK, 22060, Pakistan. ^[3] Department of Chemistry, College of Science, University of Bahrain, Bahrain. ^[4] Department of Chemistry, University of Agriculture, Faisalabad, 38000, Pakistan. Electronic address: Javed.Iqbal@uaf.edu.pk. ^[5] Department of Physics, Sakarya University, Sakarya, Turkey. ^[6] Research Center for Advanced Materials Science (RCAMS), King Khalid University, Abha, 61413, P.O. Box 9004, Saudi Arabia; Physics Department, Faculty of Science, King Khalid University, Abha,Saudi, P.O. Box 9004, Saudi Arabia. ^[7]

关键词 Density function theory (DFT)Gold cluster (Au)Graphyne (GY)Non-linear optical (NLO)

主题词金(Gold);分子构象(Molecular Conformation);谱学, 傅里叶变换红外(Spectroscopy, Fourier Transform Infrared);静电(Static Electricity);振动(Vibration)

DOI 10.1016/j.jmgm.2022.108204

PMID 35525190

发布时间 2022-06-07

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