화학공학소재연구정보센터
검색결과 : 18건
No. Article
1 Calculation of Partition Functions and Free Energies of a Binary Mixture Using the Energy Partitioning Method: Application to Carbon Dioxide and Methane
Do H, Hirst JD, Wheatley RJ
Journal of Physical Chemistry B, 116(15), 4535, 2012
2 First principles models of the interactions of methane and carbon dioxide
Oakley MT, Do H, Wheatley RJ
Fluid Phase Equilibria, 290(1-2), 48, 2010
3 Gibbs Ensemble Monte Carlo Simulations of Binary Mixtures of Methane, Difluoromethane, and Carbon Dioxide
Do H, Wheatley RJ, Hirst JD
Journal of Physical Chemistry B, 114(11), 3879, 2010
4 Intermolecular potential and ab initio spectroscopy of the Ne-HF complex
Tulegenov AS, Wheatley RJ, Nauryzbaev MK
Chemical Physics Letters, 468(4-6), 290, 2009
5 Ab initio spectroscopy of Van der Waals molecules: a comparison of three different theoretical methods applied to NeHF and NeDF
Newton DP, Bichoutskaia E, Wheatley RJ
Chemical Physics Letters, 393(1-3), 70, 2004
6 Intermolecular potential and second virial coefficient of the water-hydrogen complex
Hodges MP, Wheatley RJ, Schenter GK, Harvey AH
Journal of Chemical Physics, 120(2), 710, 2004
7 Intermolecular potential and second virial coefficient of the water-helium complex
Hodges MP, Wheatley RJ, Harvey AH
Journal of Chemical Physics, 116(4), 1397, 2002
8 Intermolecular potentials and second virial coefficients of the water-neon and water-argon complexes
Hodges MP, Wheatley RJ, Harvey AH
Journal of Chemical Physics, 117(15), 7169, 2002
9 Overlap-model and ab initio cluster calculations of ion properties in distorted environments
Domene C, Fowler PW, Wilson M, Madden PA, Wheatley RJ
Chemical Physics Letters, 333(5), 403, 2001
10 Intermolecular potential for the interaction of helium with ammonia
Hodges MP, Wheatley RJ
Journal of Chemical Physics, 114(20), 8836, 2001