James Daniel Farrell
Cited by
Cited by
Structure and torsional dynamics of the water octamer from THz laser spectroscopy near 215 μm
WTS Cole, JD Farrell, DJ Wales, RJ Saykally
Science 352 (6290), 1194-1197, 2016
Benchmarks for characterization of minima, transition states, and pathways in atomic, molecular, and condensed matter systems
ST Chill, J Stevenson, V Ruehle, C Shang, P Xiao, JD Farrell, DJ Wales, ...
Journal of chemical theory and computation 10 (12), 5476-5482, 2014
Structures and energy landscapes of hydrated sulfate clusters
LC Smeeton, JD Farrell, MT Oakley, DJ Wales, RL Johnston
Journal of Chemical Theory and Computation 11 (5), 2377-2384, 2015
Energy landscapes, structural topologies and rearrangement mechanisms in clusters of dipolar particles
JD Farrell, C Lines, JJ Shepherd, D Chakrabarti, MA Miller, DJ Wales
Soft Matter 9 (22), 5407-5416, 2013
Polymorphism and Oxide Ion Migration Pathways in Fluorite-Type Bismuth Vanadate, Bi46V8O89
X Kuang, JL Payne, JD Farrell, MR Johnson, IR Evans
Chemistry of Materials 24 (11), 2162-2167, 2012
A novel 3-D bio-microfluidic system mimicking in vivo heterogeneous tumour microstructures reveals complex tumour–stroma interactions
Q Fan, R Liu, Y Jiao, C Tian, JD Farrell, W Diao, X Wang, F Zhang, ...
Lab on a Chip 17 (16), 2852-2860, 2017
Defining and quantifying frustration in the energy landscape: Applications to atomic and molecular clusters, biomolecules, jammed and glassy systems
VK De Souza, JD Stevenson, SP Niblett, JD Farrell, DJ Wales
The Journal of Chemical Physics 146 (12), 124103, 2017
A stress tensor eigenvector projection space for the (H2O) 5 potential energy surface
T Xu, J Farrell, R Momen, A Azizi, SR Kirk, S Jenkins, DJ Wales
Chemical Physics Letters 667, 25-31, 2017
Tunable low loss 1D surface plasmons in InAs nanowires
Y Zhou, R Chen, J Wang, Y Huang, M Li, Y Xing, J Duan, J Chen, ...
Advanced Materials 30 (35), 1802551, 2018
Resolving alternative organic crystal structures using density functional theory and NMR chemical shifts
CM Widdifield, JD Farrell, JC Cole, JAK Howard, P Hodgkinson
Chemical science 11 (11), 2987-2992, 2020
Spontaneous domain formation in spherically confined elastic filaments
T Curk, JD Farrell, J Dobnikar, R Podgornik
Physical review letters 123 (4), 047801, 2019
Investigating the solid-liquid phase transition of water nanofilms using the generalized replica exchange method
Q Lu, J Kim, JD Farrell, DJ Wales, JE Straub
The Journal of Chemical Physics 141 (18), 18C525, 2014
Computational design of probes to detect bacterial genomes by multivalent binding
T Curk, CA Brackley, JD Farrell, Z Xing, D Joshi, S Direito, U Bren, ...
Proceedings of the National Academy of Sciences 117 (16), 8719-8726, 2020
Terahertz VRT spectroscopy of the water hexamer-d12 prism: Dramatic enhancement of bifurcation tunneling upon librational excitation
WTS Cole, JD Farrell, AA Sheikh, Ö Yönder, RS Fellers, MR Viant, ...
The Journal of Chemical Physics 148 (9), 094301, 2018
The mechanism of oxide ion conductivity in bismuth rhenium oxide, Bi28Re2O49
JL Payne, JD Farrell, AM Linsell, MR Johnson, IR Evans
Solid State Ionics 244, 35-39, 2013
QTAIM and stress tensor interpretation of the (H2O)5 potential energy surface
T Xu, J Farrell, Y Xu, R Momen, SR Kirk, S Jenkins, DJ Wales
Journal of Computational Chemistry 37 (31), 2712-2721, 2016
Terahertz VRT spectroscopy of the water hexamer-h12 cage: dramatic libration-induced enhancement of hydrogen bond tunneling dynamics
WTS Cole, O Yönder, AA Sheikh, RS Fellers, MR Viant, RJ Saykally, ...
The Journal of Physical Chemistry A 122 (37), 7421-7426, 2018
Clusters of coarse-grained water molecules
JD Farrell, DJ Wales
The Journal of Physical Chemistry A 118 (35), 7338-7348, 2014
Preorganized Internal Electric Field Powers Catalysis in the Active Site of Uracil-DNA Glycosylase
W Diao, S Yan, JD Farrell, B Wang, F Ye, Z Wang
ACS Catalysis 12 (20), 12488-12499, 2022
Role of genome topology in the stability of viral capsids
JD Farrell, J Dobnikar, R Podgornik
Physical Review Research 5 (1), L012040, 2023
The system can't perform the operation now. Try again later.
Articles 1–20