Showing results 1 to 13 of 13
Anisotropic Shock Sensitivity of Cyclotrimethylene Trinitramine (RDX) from Compress-and-Shear Reactive Dynamics An, Qi; Liu, Yi; Zybin, Sergey V.; Kim, Hyungjun; Goddard, William A., III, JOURNAL OF PHYSICAL CHEMISTRY C, v.116, no.18, pp.10198 - 10206, 2012-05 |
Branched Polymeric Media: Boron-Chelating Resins from Hyperbranched Polyethylenimine Mishra, Himanshu; Yu, Changjun; Chen, Dennis P.; Goddard, William A., III; Dalleska, Nathan F.; Hoffmann, Michael R.; Diallo, Mamadou S., ENVIRONMENTAL SCIENCE & TECHNOLOGY, v.46, no.16, pp.8998 - 9004, 2012-08 |
Branched Polymeric Media: Perchlorate-Selective Resins from Hyperbranched Polyethyleneimine Chen, Dennis P.; Yu, Changjun; Chang, Ching-Yu; Wan, Yanjian; Frechet, Jean M. J.; Goddard, William A., III; Diallo, Mamadou S., ENVIRONMENTAL SCIENCE & TECHNOLOGY, v.46, no.19, pp.10718 - 10726, 2012-10 |
Electronic-Mechanical Coupling in Graphene from in situ Nanoindentation Experiments and Multiscale Atomistic Simulations Huang, Mingyuan; Pascal, Tod A.; Kim, Hyungjun; Goddard, William A., III; Greer, Julia R., NANO LETTERS, v.11, no.3, pp.1241 - 1246, 2011-03 |
Embedding Covalency into Metal Catalysts for Efficient Electrochemical Conversion of CO2 Lim, Hyung Kyu; Shin, Hyeyoung; Goddard, William A., III; Hwang, Yun Jeong; Min, Byoung Koun; Kim, Hyungjun, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.136, no.32, pp.11355 - 11361, 2014-08 |
First-Principles Study of Iron Oxide Polytypes: Comparison of GGA plus U and Hybrid Functional Method Eom, Tae Dae Hyeong; Lim, Hyung Kyu; Goddard, William A., III; Kim, Hyung-Jun, JOURNAL OF PHYSICAL CHEMISTRY C, v.119, no.1, pp.556 - 562, 2015-01 |
Nanofiltration membranes based on polyvinylidene fluoride nanofibrous scaffolds and crosslinked polyethyleneimine networks Park, Seong-Jik; Cheedrala, Ravi Kumar; Diallo, Mamadou S.; Kim, Changmin; Kim, In S.; Goddard, William A., III, JOURNAL OF NANOPARTICLE RESEARCH, v.14, no.7, 2012-07 |
pH-Dependent Conformations for Hyperbranched Poly(ethylenimine) from All-Atom Molecular Dynamics Kim, In; Pascal, Tod A.; Park, Seong-Jik; Diallo, Mamadou S; Goddard, William A., III; Jung, Yousung, MACROMOLECULES, v.51, no.6, pp.2187 - 2194, 2018-03 |
Rapid Dye Regeneration Mechanism of Dye-Sensitized Solar Cells Jeon, Jiwon; Park, Young-Choon; Han, Sang Soo; Goddard, William A., III; Lee, Yoon-Sup; Kim, Hyung-Jun, JOURNAL OF PHYSICAL CHEMISTRY LETTERS, v.5, no.24, pp.4285 - 4290, 2014-12 |
Rescaling of metal oxide nanocrystals for energy storage having high capacitance and energy density with robust cycle life Jeong, Hyung Mo; Choi, Kyung Min; Cheng, Tao; Lee, Dong Ki; Zhou, Renjia; Ock, Il Woo; Milliron, Delia J.; et al, PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, v.112, no.26, pp.7914 - 7919, 2015-06 |
Scaled Effective Solvent Method for Predicting the Equilibrium Ensemble of Structures with Analysis of Thermodynamic Properties of Amorphous Polyethylene Glycol-Water Mixtures Shin, Hyeyoung; Pascal, Tod A.; Goddard, William A., III; Kim, Hyungjun, JOURNAL OF PHYSICAL CHEMISTRY B, v.117, no.3, pp.916 - 927, 2013-01 |
Time dependent behavior of a localized electron at a heterojunction boundary of graphene Jang, Min Seok; Kim, Hyungjun; Atwater, Harry A.; Goddard, William A., III, APPLIED PHYSICS LETTERS, v.97, no.4, 2010-07 |
Universal Correction of Density Functional Theory to Include London Dispersion (up to Lr, Element 103) Kim, Hyungjun; Choi, Jeong-Mo; Goddard, William A., III, JOURNAL OF PHYSICAL CHEMISTRY LETTERS, v.3, no.3, pp.360 - 363, 2012-02 |
Discover