검색결과 : 9건
| No. | Article |
|---|---|
| 1 |
Multipole Moments in the Effective Fragment Potential Method Bertoni C, Slipchenko LV, Misquitta AJ, Gordon MS Journal of Physical Chemistry A, 121(9), 2056, 2017 |
| 2 |
A transferable electrostatic model for intermolecular interactions between polycyclic aromatic hydrocarbons Totton TS, Misquitta AJ, Kraft M Chemical Physics Letters, 510(1-3), 154, 2011 |
| 3 |
Assessing the Polycyclic Aromatic Hydrocarbon Anisotropic Potential with Application to the Exfoliation Energy of Graphite Totton TS, Misquitta AJ, Kraft M Journal of Physical Chemistry A, 115(46), 13684, 2011 |
| 4 |
Modelling the internal structure of nascent soot particles Totton TS, Chakrabarti D, Misquitta AJ, Sander M, Wales DJ, Kraft M Combustion and Flame, 157(5), 909, 2010 |
| 5 |
Charge-transfer in Symmetry-Adapted Perturbation Theory Stone AJ, Misquitta AJ Chemical Physics Letters, 473(1-3), 201, 2009 |
| 6 |
A first principles prediction of the crystal structure of C6Br2ClFH2 Misquitta AJ, Welch GWA, Stone AJ, Price SL Chemical Physics Letters, 456(1-3), 105, 2008 |
| 7 |
Intermolecular forces from asymptotically corrected density functional description of monomers Misquitta AJ, Szalewicz K Chemical Physics Letters, 357(3-4), 301, 2002 |
| 8 |
Intermolecular potential energy surfaces and spectra of Ne-HCN complex from ab initio calculations Murdachaew G, Misquitta AJ, Bukowski R, Szalewicz K Journal of Chemical Physics, 114(2), 764, 2001 |
| 9 |
Spectra of Ar-CO2 from ab initio potential energy surfaces Misquitta AJ, Bukowski R, Szalewicz K Journal of Chemical Physics, 112(12), 5308, 2000 |