Ab initio methane dimer intermolecular potentials

By Nagy Jenö   Weaver Donald   Smith Vedene  

Molecular Physics, Vol. 85, Iss. 6, 1995-08 ,pp. : 1179-1192

Taylor & Francis Ltd

Access to resources Recommend Favorite

Intermolecular potential for acetonitrile based on ab initio calculations

By Cabaleiro-Lago Enrique M.   Rios Miguel A.  

Molecular Physics, Vol. 96, Iss. 3, 1999-02 ,pp. : 309-321

Taylor & Francis Ltd

Access to resources Recommend Favorite

Electron gas predictions of interatomic potentials tested by ab initio calculations

By Wood C.P.   Pyper N.C.  

Molecular Physics, Vol. 43, Iss. 6, 1981-08 ,pp. : 1371-1383

Taylor & Francis Ltd

Access to resources Recommend Favorite

Ab initio intermolecular potentials of methane, nitrogen and methane + nitrogen and their use in Monte Carlo simulations of fluids and fluid mixtures

By Schindler H.   Vogelsang R.   Staemmler V.   Siddiqi M.A.   Svejda P.  

Molecular Physics, Vol. 80, Iss. 6, 1993-12 ,pp. : 1413-1429

Taylor & Francis Ltd

Access to resources Recommend Favorite

Evaluation of anisotropic model intermolecular pair potentials using an ab initio SCF-CI surface

By Price S.L.   Stone A.J.  

Molecular Physics, Vol. 40, Iss. 4, 1980-07 ,pp. : 805-822

Taylor & Francis Ltd

Access to resources Recommend Favorite