Force field and a surface model database for silica to simulate interfacial properties in atomic resolution FS Emami, V Puddu, RJ Berry, V Varshney, SV Patwardhan, CC Perry, ... Chemistry of Materials 26 (8), 2647-2658, 2014 | 439 | 2014 |
Chemistry of aqueous silica nanoparticle surfaces and the mechanism of selective peptide adsorption SV Patwardhan, FS Emami, RJ Berry, SE Jones, RR Naik, O Deschaume, ... Journal of the American Chemical Society 134 (14), 6244-6256, 2012 | 411 | 2012 |
Adsorption mechanism of single amino acid and surfactant molecules to Au {111} surfaces in aqueous solution: design rules for metal-binding molecules J Feng, RB Pandey, RJ Berry, BL Farmer, RR Naik, H Heinz Soft Matter 7 (5), 2113-2120, 2011 | 229 | 2011 |
Molecular dynamics simulation study of norbornene–POSS polymers RK Bharadwaj, RJ Berry, BL Farmer Polymer 41 (19), 7209-7221, 2000 | 221 | 2000 |
Prediction of specific biomolecule adsorption on silica surfaces as a function of pH and particle size FS Emami, V Puddu, RJ Berry, V Varshney, SV Patwardhan, CC Perry, ... Chemistry of Materials 26 (19), 5725-5734, 2014 | 148 | 2014 |
Derivation of class II force fields. VIII. Derivation of a general quantum mechanical force field for organic compounds CS Ewig, R Berry, U Dinur, JR Hill, MJ Hwang, H Li, C Liang, JON Maple, ... Journal of computational chemistry 22 (15), 1782-1800, 2001 | 107 | 2001 |
Computational study of the kinetics of hydrogen abstraction from fluoromethanes by the hydroxyl radical M Schwartz, P Marshall, RJ Berry, CJ Ehlers, GA Petersson The Journal of Physical Chemistry A 102 (49), 10074-10081, 1998 | 104 | 1998 |
The use of scaled moments of inertia in experimental structure determinations of polyatomic molecules RJ Berry, MD Harmony Structural Chemistry 1, 49-59, 1990 | 96 | 1990 |
Vibrational spectra and assignments, normal coordinate analyses, ab initio calculations, and conformational stability of the propenoyl halides JR Durig, RJ Berry, P Groner The Journal of chemical physics 87 (11), 6303-6322, 1987 | 93 | 1987 |
Spectroscopic evaluation of charge-transfer doping and strain in graphene/ heterostructures R Rao, AE Islam, S Singh, R Berry, RK Kawakami, B Maruyama, J Katoch Physical Review B 99 (19), 195401, 2019 | 84 | 2019 |
Molecular engineering of interphases in polymer/carbon nanotube composites to reach the limits of mechanical performance C Pramanik, D Nepal, M Nathanson, JR Gissinger, A Garley, RJ Berry, ... Composites Science and Technology 166, 86-94, 2018 | 74 | 2018 |
AlphaFold2 models indicate that protein sequence determines both structure and dynamics HB Guo, A Perminov, S Bekele, G Kedziora, S Farajollahi, V Varaljay, ... Scientific Reports 12 (1), 10696, 2022 | 69 | 2022 |
Halon thermochemistry: ab initio calculations of the enthalpies of formation of fluoromethanes RJ Berry, DRF Burgess Jr, MR Nyden, MR Zachariah, M Schwartz The Journal of Physical Chemistry 99 (47), 17145-17150, 1995 | 67 | 1995 |
Simulations of peptide-graphene interactions in explicit water AN Camden, SA Barr, RJ Berry The Journal of Physical Chemistry B 117 (37), 10691-10697, 2013 | 65 | 2013 |
A computational study of the reactions of atomic hydrogen with fluoromethanes: kinetics and product channels RJ Berry, CJ Ehlers, DR Burgess Jr, MR Zachariah, P Marshall Chemical physics letters 269 (1-2), 107-116, 1997 | 60 | 1997 |
Halon thermochemistry: calculated enthalpies of formation of chlorofluoromethanes RJ Berry, DRF Burgess, MR Nyden, MR Zachariah, CF Melius, ... The Journal of Physical Chemistry 100 (18), 7405-7410, 1996 | 58 | 1996 |
Dielectric characteristics of polyimide CP2 JD Jacobs, MJ Arlen, DH Wang, Z Ounaies, R Berry, LS Tan, PH Garrett, ... Polymer 51 (14), 3139-3146, 2010 | 52 | 2010 |
Impact of polymer structure and confinement on the kinetics of Zdol 4000 bonding to amorphous‐hydrogenated carbon RJ Waltman, GW Tyndall, J Pacansky, RJ Berry Tribology Letters 7, 91-102, 1999 | 39 | 1999 |
Thermodynamic Properties (ΔHf(298), S(298), and Cp(T) (300 ≤ T ≤ 1500)) of Fluorinated Propanes T Yamada, JW Bozzelli, RJ Berry The Journal of Physical Chemistry A 103 (28), 5602-5610, 1999 | 38 | 1999 |
The use of scaled moments of inertia in experimental structure determinations: Extension to simple molecules containing hydrogen RJ Berry, MD Harmony Journal of Molecular Spectroscopy 128 (1), 176-194, 1988 | 38 | 1988 |