Mao AJ - Search Results

1

Theoretical study on local defect structure of (FeO4)(5-) clusters in YGG and LGG crystals.

Li HL, Kuang XY, Li Y, Mao AJ. Li HL, et al. Among authors: mao aj. Spectrochim Acta A Mol Biomol Spectrosc. 2009 Jul 15;73(2):273-6. doi: 10.1016/j.saa.2009.02.024. Epub 2009 Feb 21. Spectrochim Acta A Mol Biomol Spectrosc. 2009. PMID: 19297241

2

EPR theoretical study of local molecular structure and thermal expansion coefficient for octahedral Mn2+ centers in zinc fluosilicate.

Mao AJ, Kuang XY, Wang H, Lu C. Mao AJ, et al. J Phys Chem A. 2006 May 4;110(17):5869-73. doi: 10.1021/jp056901h. J Phys Chem A. 2006. PMID: 16640383

3

Theoretical study of EPR spectra for Mn2+ ion in [Mg(H2O)6]SnCl6 single crystal.

Mao AJ, Kuang XY, Tan XM, Wang H, Li JF. Mao AJ, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2007 Jul;67(3-4):890-3. doi: 10.1016/j.saa.2006.09.005. Epub 2006 Dec 4. Spectrochim Acta A Mol Biomol Spectrosc. 2007. PMID: 17142089

4

Tetragonal distortion of structural defects in Cr3+ doped in several perovskites calculated from the EPR and optical data: a complete energy matrix study.

Mao AJ, Kuang XY. Mao AJ, et al. J Phys Chem A. 2008 Aug 7;112(31):7280-5. doi: 10.1021/jp801709u. Epub 2008 Jul 11. J Phys Chem A. 2008. PMID: 18616235

5

A DFT study on equilibrium geometries, stabilities, and electronic properties of small bimetallic Na-doped Au(n) (n = 1-9) clusters: comparison with pure gold clusters.

Li YF, Kuang XY, Mao AJ, Li Y, Zhao YR. Li YF, et al. Among authors: mao aj. J Mol Model. 2012 Jan;18(1):329-38. doi: 10.1007/s00894-011-1073-9. Epub 2011 Apr 27. J Mol Model. 2012. PMID: 21523532

6

Density functional study on size-dependent structures, stabilities, electronic and magnetic properties of Au(n)M (M = Al and Si, n = 1-9) clusters: comparison with pure gold clusters.

Li YF, Mao AJ, Li Y, Kuang XY. Li YF, et al. Among authors: mao aj. J Mol Model. 2012 Jul;18(7):3061-72. doi: 10.1007/s00894-011-1317-8. Epub 2011 Dec 14. J Mol Model. 2012. PMID: 22167528

7

Studies of EPR spectra and defect structure for Er³⁺ ions in BaF₂ and SrF₂ crystals.

Li H, Kuang XY, Mao AJ, Li CG. Li H, et al. Among authors: mao aj. Spectrochim Acta A Mol Biomol Spectrosc. 2013 Feb;102:169-74. doi: 10.1016/j.saa.2012.10.045. Epub 2012 Nov 1. Spectrochim Acta A Mol Biomol Spectrosc. 2013. PMID: 23220532

8

Large polarization and dielectric response in epitaxial SrZrO3 films.

Tian H, Mao AJ, Zhao HJ, Cui Y, Li H, Kuang XY. Tian H, et al. Among authors: mao aj. Phys Chem Chem Phys. 2016 Mar 21;18(11):7680-7. doi: 10.1039/c5cp07881d. Phys Chem Chem Phys. 2016. PMID: 26908044

9

Hydrostatic pressure induced structural phase transition and mechanical properties of fluoroperovskite.

Cheng H, Mao AJ, Cheng XR, Tian H, Dou XL, Yang SM, Kuang XY. Cheng H, et al. Among authors: mao aj. J Phys Condens Matter. 2019 Dec 18;31(50):505406. doi: 10.1088/1361-648X/ab420d. J Phys Condens Matter. 2019. PMID: 31491779

10

Pressure-induced reconstructive phase transitions, polarization with metallicity, and enhanced hardness in antiperovskite MgCNi₃.

Cui Y , Cheng H , Tian H , Li C , Tang Y , Mao AJ , Kuang XY . Cui Y , et al. Among authors: mao aj. Phys Chem Chem Phys. 2021 Sep 7;23(33):18221-18226. doi: 10.1039/d1cp02742e. Epub 2021 Aug 17. Phys Chem Chem Phys. 2021. PMID: 34612285

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