Wen ShuHao 温书豪
Wen ShuHao 温书豪
MIT, MA(2013-); UCR,CA(2010-2013); DICP, China(2004-2010)
Подтвержден адрес электронной почты в домене mit.edu
Superhydrophobic conjugated microporous polymers for separation and adsorption
A Li, HX Sun, DZ Tan, WJ Fan, SH Wen, XJ Qing, GX Li, SY Li, WQ Deng
Energy & Environmental Science 4 (6), 2062-2065, 2011
First-principles investigation of anistropic hole mobilities in organic semiconductors
SH Wen, A Li, J Song, WQ Deng, KL Han, WA Goddard III
The Journal of Physical Chemistry B 113 (26), 8813-8819, 2009
Accurate molecular crystal lattice energies from a fragment QM/MM approach with on-the-fly ab initio force field parametrization
S Wen, GJO Beran
Journal of chemical theory and computation 7 (11), 3733-3742, 2011
Quantitative prediction of charge mobilities of π-stacked systems by first-principles simulation
SHWKLH Wei-Qiao Deng, Lei Sun, Jin-Dou Huang, Shuo Chai
Nature Protocols 10, 632–642, 2015
Practical quantum mechanics-based fragment methods for predicting molecular crystal properties
S Wen, K Nanda, Y Huang, GJO Beran
Physical Chemistry Chemical Physics 14 (21), 7578-7590, 2012
Boron Carbides as Efficient, Metal‐Free, Visible‐Light‐Responsive Photocatalysts
J Liu, S Wen, Y Hou, F Zuo, GJO Beran, P Feng
Angewandte Chemie International Edition, 2013
Simulation of hole mobility in α-oligofuran crystals
JD Huang, SH Wen, WQ Deng, KL Han
The Journal of Physical Chemistry B 115 (10), 2140-2147, 2011
Density functional theory study on electron and hole transport properties of organic pentacene derivatives with electron‐withdrawing substituent
S Chai, SH Wen, JD Huang, KL Han
Journal of computational chemistry 32 (15), 3218-3225, 2011
Revealing quantitative structure–activity relationships of transport properties in acene and acene derivative organic materials
SH Wen, WQ Deng, KL Han
Physical Chemistry Chemical Physics 12 (32), 9267-9275, 2010
Accidental degeneracy in crystalline aspirin: New insights from high-level ab initio calculations
S Wen, GJO Beran
Crystal growth & design 12 (5), 2169-2172, 2012
Understanding electron-withdrawing substituent effect on structural, electronic and charge transport properties of perylene bisimide derivatives
S Chai, SH Wen, KL Han
Organic electronics 12 (11), 1806-1814, 2011
Preparation of poly (acrylic acid)–graphite oxide superabsorbent nanocomposites
ZQ Zhu, HX Sun, XJ Qin, L Jiang, CJ Pei, L Wang, YQ Zeng, SH Wen, ...
Journal of Materials Chemistry 22 (11), 4811-4817, 2012
Ultra-low resistance at TTF–TCNQ organic interfaces
S Wen, WQ Deng, KL Han
Chemical Communications 46 (28), 5133-5135, 2010
Crystal polymorphism in oxalyl dihydrazide: Is empirical DFT-D accurate enough?
S Wen, GJO Beran
Journal of chemical theory and computation 8 (8), 2698-2705, 2012
Aryl/hetero-arylethyne bridged dyes: the effect of planar π-bridge on the performance of dye-sensitized solar cells
JL Song, P Amaladass, SH Wen, KK Pasunooti, A Li, YL Yu, X Wang, ...
New Journal of Chemistry 35 (1), 127-136, 2011
Endohedral BN Metallofullerene M@B36N36 Complex As Promising Hydrogen Storage Materials
SH Wen, WQ Deng, KL Han
The Journal of Physical Chemistry C 112 (32), 12195-12200, 2008
First‐Principles Investigation of the Electronic and Conducting Properties of Oligothienoacenes and their Derivatives
JD Huang, SH Wen, KL Han
Chemistry–An Asian Journal 7 (5), 1032-1040, 2012
Accurate and Robust Molecular Crystal Modeling Using Fragment-Based Electronic Structure Methods
YH Gregory Beran, Shuhao Wen, Kaushik Nanda, Yuanhang
Topics in current chemistry, 2013
Accurate and robust molecular crystal modeling using fragment-based electronic structure methods
GJO Beran, S Wen, K Nanda, Y Huang, Y Heit
Prediction and Calculation of Crystal Structures, 59-93, 2013
Band gap narrowing of TiO2 by compensated codoping for enhanced photocatalytic activity
J Huang, S Wen, J Liu, G He
Journal of natural gas chemistry 21 (3), 302-307, 2012
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