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Bun Chan
Bun Chan
Verified email at nagasaki-u.ac.jp
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Cited by
Year
Effect of structural character of gold nanoparticles in nanofluid on heat pipe thermal performance
CY Tsai, HT Chien, PP Ding, B Chan, TY Luh, PH Chen
Materials Letters 58 (9), 1461-1465, 2004
5242004
Rapid additive-free selenocystine–selenoester peptide ligation
NJ Mitchell, LR Malins, X Liu, RE Thompson, B Chan, L Radom, ...
Journal of the American Chemical Society 137 (44), 14011-14014, 2015
1472015
Controlling charge separation in a novel donor–acceptor metal–organic framework via redox modulation
CF Leong, B Chan, TB Faust, DM D'Alessandro
Chemical Science 5 (12), 4724-4728, 2014
1372014
G4 (MP2)-6X: A cost-effective improvement to G4 (MP2)
B Chan, J Deng, L Radom
Journal of Chemical Theory and Computation 7 (1), 112-120, 2011
1302011
Chemoselective peptide ligation–desulfurization at aspartate
RE Thompson, B Chan, L Radom, KA Jolliffe, RJ Payne
Angewandte Chemie 125 (37), 9905-9909, 2013
1272013
Through-space intervalence charge transfer as a mechanism for charge delocalization in metal–organic frameworks
C Hua, PW Doheny, B Ding, B Chan, M Yu, CJ Kepert, DM D’Alessandro
Journal of the American Chemical Society 140 (21), 6622-6630, 2018
982018
W2X and W3X-L: Cost-Effective Approximations to W2 and W4 with kJ mol–1 Accuracy
B Chan, L Radom
Journal of chemical theory and computation 11 (5), 2109-2119, 2015
932015
Reactivity of disulfide bonds is markedly affected by structure and environment: implications for protein modification and stability
M Karimi, MT Ignasiak, B Chan, AK Croft, L Radom, CH Schiesser, ...
Scientific reports 6 (1), 1-12, 2016
862016
W1X-1 and W1X-2: W1-quality accuracy with an order of magnitude reduction in computational cost
B Chan, L Radom
Journal of Chemical Theory and Computation 8 (11), 4259-4269, 2012
712012
Modelling the interaction of molecular hydrogen with lithium-doped hydrogen storage materials
SJ Kolmann, B Chan, MJT Jordan
Chemical Physics Letters 467 (1-3), 126-130, 2008
702008
Zeolite-catalyzed hydrogenation of carbon dioxide and ethene
B Chan, L Radom
Journal of the American Chemical Society 130 (30), 9790-9799, 2008
682008
Design of Effective Zeolite Catalysts for the Complete Hydrogenation of CO2
B Chan, L Radom
Journal of the American Chemical Society 128 (16), 5322-5323, 2006
652006
Determination of Barrier Heights for Proton Exchange in Small Water, Ammonia, and Hydrogen Fluoride Clusters with G4 (MP2)-Type, MP n, and SCS-MP n Procedures A Caveat
A Karton, RJ O’Reilly, B Chan, L Radom
Journal of Chemical Theory and Computation 8 (9), 3128-3136, 2012
642012
BDE261: a comprehensive set of high-level theoretical bond dissociation enthalpies
B Chan, L Radom
The Journal of Physical Chemistry A 116 (20), 4975-4986, 2012
622012
Assessment of DFT methods for transition metals with the TMC151 compilation of data sets and comparison with accuracies for main-group chemistry
B Chan, PMW Gill, M Kimura
Journal of chemical theory and computation 15 (6), 3610-3622, 2019
612019
Increasing spin crossover cooperativity in 2D Hofmann-type materials with guest molecule removal
KA Zenere, SG Duyker, E Trzop, E Collet, B Chan, PW Doheny, CJ Kepert, ...
Chemical science 9 (25), 5623-5629, 2018
602018
Obtaining good performance with triple-ζ-type basis sets in double-hybrid density functional theory procedures
B Chan, L Radom
Journal of Chemical Theory and Computation 7 (9), 2852-2863, 2011
582011
Evaluation of the Heats of Formation of Corannulene and C60 by Means of High-Level Theoretical Procedures
A Karton, B Chan, K Raghavachari, L Radom
The Journal of Physical Chemistry A 117 (8), 1834-1842, 2013
562013
W3X: A cost-effective post-CCSD (T) composite procedure
B Chan, L Radom
Journal of Chemical Theory and Computation 9 (11), 4769-4778, 2013
552013
Accelerated protein synthesis via one-pot ligation-deselenization chemistry
NJ Mitchell, J Sayers, SS Kulkarni, D Clayton, AM Goldys, ...
Chem 2 (5), 703-715, 2017
512017
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