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The Journal of Chemical Physics|July 24, 2010
Monte Carlo study of oligopyrroles in condensed phasesYafei Dai, Estela Blaisten-BarojasThe Journal of Chemical Physics|December 3, 2008
Energetics, structure, and charge distribution of reduced and oxidized n-pyrrole oligomers: a density functional approachYafei Dai, Estela Blaisten-BarojasThe Journal of Physical Chemistry. A|October 16, 2008
Energetics, structure, and electron detachment spectra of calcium and zinc neutral and anion clusters: a density functional theory studyYafei Dai, Estela Blaisten-BarojasChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|August 8, 2015
A Density Functional Study of the Nonlinear Optical Properties of Edge-Functionalized Nonplanar NanographenesYafei Dai, Zhenyu Li, Jinlong YangPhysical Review Letters|September 27, 2014
Comment on "electrical-driven transport of endohedral fullerene encapsulating a single water molecule"Zhendong Chi, Chenglin Luo, Yafei DaiNanoscale|November 8, 2017
Porous germanene as a highly efficient gas separation membraneAng Bian, Yafei Dai, Jinlong YangThe Journal of Chemical Physics|December 11, 2013
Density functional theory study of neutral and oxidized thiophene oligomersYafei Dai, Chengwei Wei, Estela Blaisten-BarojasThe Journal of Physical Chemistry. A|August 28, 2009
Energetics and vibrational analysis of methyl salicylate isomersRichard D Massaro, Yafei Dai, Estela Blaisten-BarojasJournal of Physics. Condensed Matter : an Institute of Physics Journal|September 13, 2013
Diffusion and desorption of oxygen atoms on grapheneYafei Dai, Shuang Ni, Zhenyu Li, et al.Chemical Communications (Cambridge, England)|June 30, 2016
Cavity partition and functionalization of a [2+3] organic molecular cage by inserting polar P[double bond, length as m-dash]O bondsGenfeng Feng, Wei Liu, Yuxin Peng, et al.Pageof 3