Natural Bond Orbital (NBO), Natural Population Analysis (NPA) and Non Linear Optical Properties of (1S, 2R)-2-amino-1-phenylpropan-1-ol Using DFT Method

C. Charanya; S. Sampathkrishnan; N. Balamurugan

doi:doi:10.3964/j.issn.1000-0593(2017)09-2984-05

光谱学与光谱分析, 2017, 37 (9): 2984, 网络出版: 2017-10-16

Natural Bond Orbital (NBO), Natural Population Analysis (NPA) and Non Linear Optical Properties of (1S, 2R)-2-amino-1-phenylpropan-1-ol Using DFT Method

C. Charanya ¹S. Sampathkrishnan ²N. Balamurugan ^3,*

作者单位

¹ Research Scholar, Department of Physics, Sri Venkateshwara College of Engineering, Sriperumbudur 602105, Tamil Nadu, India

² Department of Physics, Sri Venkateswara College of Engineering, Sriperumbudur 602105, Tamil Nadu, India

³ Department of Physics, Dhanalakshmi College of Engineering, Tambaram, Chennai, Tamil Nadu, India

基本信息

DOI:	10.3964/j.issn.1000-0593(2017)09-2984-05
中图分类号:	O433
栏目:
项目基金:	--
收稿日期:	2016-05-29
修改稿日期:	2016-10-20
网络出版日期:	2017-10-16
通讯作者:	N. Balamurugan (n_rishibalaa@yahoo.co.in)
备注:	--

C. Charanya, S. Sampathkrishnan, N. Balamurugan. Natural Bond Orbital (NBO), Natural Population Analysis (NPA) and Non Linear Optical Properties of (1S, 2R)-2-amino-1-phenylpropan-1-ol Using DFT Method[J]. 光谱学与光谱分析, 2017, 37(9): 2984. C. Charanya, S. Sampathkrishnan, N. Balamurugan. Natural Bond Orbital (NBO), Natural Population Analysis (NPA) and Non Linear Optical Properties of (1S, 2R)-2-amino-1-phenylpropan-1-ol Using DFT Method[J]. Spectroscopy and Spectral Analysis, 2017, 37(9): 2984.

Natural Bond Orbital (NBO), Natural Population Analysis (NPA) and Non Linear Optical Properties of (1S, 2R)-2-amino-1-phenylpropan-1-ol Using DFT Method

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