| 1 |
Modeling Flexible Molecules in Solution: A pK(a) Case Study
Haworth NL, Wang QR, Coote ML
Journal of Physical Chemistry A, 121(27), 5217, 2017 |
| 2 |
Mechanical Stretching-Induced Electron-Transfer Reactions and Conductance Switching in Single Molecules
Li YQ, Haworth NL, Xiang LM, Ciampi S, Coote ML, Tao NJ
Journal of the American Chemical Society, 139(41), 14699, 2017 |
| 3 |
Ambient Temperature Transition-Metal-Free Dissociative Electron Transfer Reversible Addition-Fragmentation Chain Transfer Polymerization (DET-RAFT) of Methacrylates, Acrylates, and Styrene
Maximiano P, Mendonca PV, Costa JRC, Haworth NL, Serra AC, Guliashvili T, Coote ML, Coelho JFJ
Macromolecules, 49(5), 1597, 2016 |
| 4 |
Role of Water in the Dynamic Disproportionation of Zn-Based TCNQ(F-4) Coordination Polymers (TCNQ = Tetracyanoquinodimethane)
Nafady A, Le TH, Vo N, Haworth NL, Bond AM, Martin LL
Inorganic Chemistry, 53(4), 2268, 2014 |
| 5 |
Structures and thermochemistry of calcium-containing molecules
Haworth NL, Sullivan MB, Wilson AK, Martin JML, Radom L
Journal of Physical Chemistry A, 109(40), 9156, 2005 |
| 6 |
An experimental and theoretical investigation of the triple fragmentation of CFClBr2 by photolysis near 250 nm
Owens NL, Nauta K, Kable SH, Haworth NL, Bacskay GB
Chemical Physics Letters, 370(3-4), 469, 2003 |
| 7 |
An ab initio quantum chemical and kinetic study of the NNH+O reaction potential energy surface: How important is this route to NO in combustion?
Haworth NL, Mackie JC, Bacskay GB
Journal of Physical Chemistry A, 107(35), 6792, 2003 |
| 8 |
Heats of formation of phosphorus compounds determined by current methods of computational quantum chemistry
Haworth NL, Bacskay GB
Journal of Chemical Physics, 117(24), 11175, 2002 |
| 9 |
The role of phosphorus dioxide in the H+OH recombination reaction: Ab initio quantum chemical computation of thermochemical and rate parameters
Haworth NL, Bacskay GB, Mackie JC
Journal of Physical Chemistry A, 106(8), 1533, 2002 |
| 10 |
Reactions of phosphorus-containing species of importance in the catalytic recombination of H+OH: Quantum chemical and kinetic studies
Mackie JC, Bacskay GB, Haworth NL
Journal of Physical Chemistry A, 106(45), 10825, 2002 |
