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The Moving-Grid Effect in the Harmonic Vibrational Frequency Calculations with Numeric Atom-Centered Orbitals 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2020, 卷号: 124, 期号: 14, 页码: 2897-2906
作者:  Shang, Honghui;  Yang, Jinlong
收藏  |  浏览/下载：2/0  |  提交时间：2020/12/10
Thiolate-Protected Hollow Gold Nanospheres 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2018, 卷号: 34, 期号: 7, 页码: 770-775
作者:  Xu, WW;  Gao, Y
收藏  |  浏览/下载：20/0  |  提交时间：2018/09/06
Uniaxial Negative Thermal Expansion, Negative Linear Compressibility, and Negative Poisson's Ratio Induced by Specific Topology in Zn[Au(CN)(2)](2) 期刊论文
INORGANIC CHEMISTRY, 2017, 卷号: 56, 期号: 24, 页码: 15101-15109
作者:  Sun, Ying;  Wang, Lei;  Luo, Hubin;  Deng, Shenghua;  Wang, Cong
收藏  |  浏览/下载：16/0  |  提交时间：2018/12/04
功率流测量以及振动能量参数估计试验研究 期刊论文
2016, 2016
乔百杰; 赵彤; 陈雪峰; QIAO Bai-jie; ZHAO Tong; CHEN Xue-feng
收藏  |  浏览/下载：6/0
Clumped-isotope signatures at equilibrium of CH4, NH3, H2O, H2S and SO2 期刊论文
Geochimica et Cosmochimica Acta, 2016, 卷号: 175, 期号: 2, 页码: 252-270
作者:  Qi Liu;  Yun Liu
收藏  |  浏览/下载：9/0  |  提交时间：2017/05/22
Molecular properties of excited electronic state: Formalism, implementation, and applications of analytical second energy derivatives within the framework of the time-dependent density functional theory/molecular mechanics 期刊论文
http://dx.doi.org/10.1063/1.4863563, 2014
Zeng, Qiao; Liu, Jie; Liang, WanZhen; 刘婕; 梁万珍
收藏  |  浏览/下载：5/0  |  提交时间：2015/07/22
Matching Rules for Collective Behaviors on Complex Networks: Optimal Configurations for Vibration Frequencies of Networked Harmonic Oscillators 期刊论文
PLOS ONE, 2013, 卷号: 8, 期号: 12
作者:  Zhan, Meng;  Liu, Shuai;  He, Zhiwei
收藏  |  浏览/下载：15/0  |  提交时间：2015/06/23
Binding interaction and raman spectra of p-π conjugated molecules containing CH2/NH2 groups adsorbed on silver surfaces: A DFT study of wagging modes 期刊论文
http://dx.doi.org/10.1021/jp4042777, 2013
Tao, Sha; Yu, Li-Juan; Pang, Ran; Huang, Yi-Fan; Wu, De-Yin; Tian, Zhong-Qun; 吴德印; 田中群
收藏  |  浏览/下载：2/0  |  提交时间：2015/07/22
Phonons in two-dimensional soft colloidal crystals 期刊论文
PHYSICAL REVIEW E, 2013, 卷号: 88, 期号: 2
Chen, K; Still, T; Schoenholz, S; Aptowicz, KB; Schindler, M; Maggs, AC; Liu, AJ; Yodh, AG
收藏  |  浏览/下载：14/0  |  提交时间：2014/01/16
Vibrational mode analysis and heat capacity calculation of K2SiSi3O9-wadeite 期刊论文
physics and chemistry of minerals, 2013
Chang, Linlin; Liu, Xi; Liu, Hong; Kojitani, Hiroshi; Wang, Sicheng
收藏  |  浏览/下载：4/0  |  提交时间：2015/11/10

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