Publication Cover
Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 35, 1978 - Issue 3
35
Views
81
CrossRef citations to date
0
Altmetric
Original Articles

Triple-dipole energies for H, He, Li, N, O, H2, N2, O2, NO, N2O, H2O, NH3 and CH4 evaluated using pseudo-spectral dipole oscillator strength distributions

, , &
Pages 747-757 | Received 20 Sep 1977, Published online: 22 Aug 2006

Keep up to date with the latest research on this topic with citation updates for this article.

Read on this site (14)

ASHOK KUMAR, MUKESH KUMAR & WILLIAMJ. MEATH. (2003) Dipole oscillator strengths, dipole properties and dispersion energies for SiF4 . Molecular Physics 101:10, pages 1535-1543.
Read now
MUKESH KUMAR, ASHOK KUMAR & WILLIAMJ. MEATH. (2002) Dipole oscillator strength properties and dispersion energies for CI2 . Molecular Physics 100:20, pages 3271-3279.
Read now
K. LEONHARD & U.K. DEITERS. (2002) Monte Carlo simulations of nitrogen using an ab initio potential. Molecular Physics 100:15, pages 2571-2585.
Read now
SeanA.C. McDowell, Ashok Kumar & WilliamJ. Meath. (1996) On the anisotropy of the triple-dipole dispersion energy for interactions involving linear molecules. Molecular Physics 87:4, pages 845-858.
Read now
Ashok Kumar & WilliamJ. Meath. (1992) Dipole oscillator strength properties and dispersion energies for acetylene and benzene. Molecular Physics 75:2, pages 311-324.
Read now
P.W. Fowler, P. Lazzeretti & R. Zanasi. (1989) Anisotropic dispersion forces in methane mixtures. Molecular Physics 68:4, pages 853-865.
Read now
M. Rami Reddy, SeamusF. O'Shea & Gianni Cardini. (1986) Analytical approximations to virial coefficients for pure and mixed systems. Molecular Physics 57:4, pages 841-856.
Read now
F. Visser & P.E.S. Wormer. (1984) The non-empirical calculation of second order molecular properties by means of effective states. Molecular Physics 52:4, pages 923-937.
Read now

Articles from other publishers (67)

Kristina M. Herman, Anthony J. Stone & Sotiris S. Xantheas. (2023) Accurate Calculation of Many-Body Energies in Water Clusters Using a Classical Geometry-Dependent Induction Model. Journal of Chemical Theory and Computation 19:19, pages 6805-6815.
Crossref
Laura Abella & Jochen Autschbach. (2022) Density Functional Response Calculations of Dispersion Coefficients C 6 and C 9 of Closed- and Open-Shell Systems . The Journal of Physical Chemistry A 126:34, pages 5821-5831.
Crossref
Robert Hellmann. (2022) Eighth-Order Virial Equation of State for Methane from Accurate Two-Body and Nonadditive Three-Body Intermolecular Potentials. The Journal of Physical Chemistry B 126:21, pages 3920-3930.
Crossref
Andrew P. Jones, Jason Crain, Vlad P. Sokhan, Troy W. Whitfield & Glenn J. Martyna. (2013) Quantum Drude oscillator model of atoms and molecules: Many-body polarization and dispersion interactions for atomistic simulation. Physical Review B 87:14.
Crossref
L. W. Bruch & J. Z. Larese. (2012) Initial stages of square lattice stacks of CH /MgO(001) . Physical Review B 85:3.
Crossref
Ashok Kumar & Ajit J. Thakkar. (2010) Dipole oscillator strength distributions with improved high-energy behavior: Dipole sum rules and dispersion coefficients for Ne, Ar, Kr, and Xe revisited. The Journal of Chemical Physics 132:7.
Crossref
A Kumar, B L Jhanwar & W Meath. (2007) Dipole oscillator strength distributions, properties, and dispersion energies for ethylene, propene, and 1-butene. Canadian Journal of Chemistry 85:10, pages 724-737.
Crossref
Mahendra Singh, Kai Leonhard & Klaus Lucas. (2007) Making equation of state models predictive. Fluid Phase Equilibria 258:1, pages 16-28.
Crossref
Saman Alavi, J. A. Ripmeester & D. D. Klug. (2007) Molecular dynamics study of the stability of methane structure H clathrate hydrates. The Journal of Chemical Physics 126:12.
Crossref
Robert Moszynski. 2007. Molecular Materials with Specific Interactions – Modeling and Design. Molecular Materials with Specific Interactions – Modeling and Design 1 152 .
Ashok Kumar, B. L. Jhanwar & William J. Meath. (2005) Dipole Oscillator Strength Distributions and Properties for Methanol, Ethanol and Propan-1-ol and Related Dispersion Energies. Collection of Czechoslovak Chemical Communications 70:8, pages 1196-1224.
Crossref
Ashok Kumar, Mukesh Kumar & William J. Meath. (2003) Dipole oscillator strength properties and dispersion energies for SiH4. Chemical Physics 286:2-3, pages 227-236.
Crossref
Ashok Kumar. (2002) Reliable isotropic dipole properties and dispersion energy coefficients for CCl4. Journal of Molecular Structure: THEOCHEM 591:1-3, pages 91-99.
Crossref
M. H. Champagne, X. Li & K. L. C. Hunt. (2000) Nonadditive three-body polarizabilities of molecules interacting at long range: Theory and numerical results for the inert gases, H2, N2, CO2, and CH4. The Journal of Chemical Physics 112:4, pages 1893-1906.
Crossref
Anthony J. Stone. 2000. Recent Theoretical and Experimental Advances in Hydrogen Bonded Clusters. Recent Theoretical and Experimental Advances in Hydrogen Bonded Clusters 25 34 .
Thomas Lenzer, Michael R. Furlanetto, Nicholas L. Pivonka & Daniel M. Neumark. (1999) Zero electron kinetic energy and threshold photodetachment spectroscopy of XenI− clusters (n=2–14): Binding, many-body effects, and structures. The Journal of Chemical Physics 110:14, pages 6714-6731.
Crossref
F.M. Floris & A. Tani. 1999. Molecular Dynamics - From Classical to Quantum Methods. Molecular Dynamics - From Classical to Quantum Methods 363 429 .
Sean AC McDowell & W J Meath. (1998) Article. Canadian Journal of Chemistry 76:4, pages 483-489.
Crossref
Jonathon K. Gregory & David C. Clary. 1998. Molecular Clusters. Molecular Clusters 311 363 .
Sean A.C. McDowell & W.J. Meath. (1997) On the triple-dipole dispersion energy for non-spherical molecules with an application to the O2O2O2 interaction. Chemical Physics 223:1, pages 23-32.
Crossref
X. Li & K. L. C. Hunt. (1997) Nonadditive three-body dipoles of inert gas trimers and H2⋯H2⋯H2: Long-range effects in far infrared absorption and triple vibrational transitions. The Journal of Chemical Physics 107:11, pages 4133-4153.
Crossref
Mircea Marinescu & Anthony F. Starace. (1997) Three-body dispersion coefficients for alkali-metal atoms. Physical Review A 55:3, pages 2067-2074.
Crossref
Ashok Kumar, William J. Meath, Peter Bündgen & Ajit J. Thakkar. (1996) Reliable anisotropic dipole properties, and dispersion energy coefficients, for O2 evaluated using constrained dipole oscillator strength techniques. The Journal of Chemical Physics 105:12, pages 4927-4937.
Crossref
Ivan Yourshaw, Yuexing Zhao & Daniel M. Neumark. (1996) Many-body effects in weakly bound anion and neutral clusters: Zero electron kinetic energy spectroscopy and threshold photodetachment spectroscopy of Ar n Br− ( n =2–9) and Ar n I− ( n =2–19) . The Journal of Chemical Physics 105:2, pages 351-373.
Crossref
Sean A.C. McDowell, Ashok Kumar & William J. Meath. (1996) Anisotropic and isotropic triple-dipole dispersion energy coefficients for all three-body interactions involving He, Ne, Ar, Kr, Xe, H 2 , N 2 , and CO . Canadian Journal of Chemistry 74:6, pages 1180-1186.
Crossref
David F. R. Brown, Jonathon K. Gregory & David C. Clary. (1996) A method to calculate vibrational frequency shifts in heteroclusters: application to N 2 + –He n . J. Chem. Soc., Faraday Trans. 92:1, pages 11-15.
Crossref
Jonathon K. Gregory & David C. Clary. (1995) Three-body effects on molecular properties in the water trimer. The Journal of Chemical Physics 103:20, pages 8924-8930.
Crossref
Ashok Kumar & William J. Meath. (1994) Reliable isotropic and anisotropic dipole properties, and dipolar dispersion energy coefficients, for CO evaluated using constrained dipole oscillator strength techniques. Chemical Physics 189:3, pages 467-477.
Crossref
R. Kelterbaum, N. Turki, A. Rahmouni & E. Kochanski. (1994) About the nature of intermolecular three-body forces in ionic systems: The case of protonated hydrates. The Journal of Chemical Physics 100:2, pages 1589-1598.
Crossref
Darryl J. Chartrand, Robert J. LeRoy, Ashok Kumar & William J. Meath. (1993) Effect of three-body forces on the statics and dynamics of SF6–(Rg) n and (Rg)13 clusters . The Journal of Chemical Physics 98:7, pages 5668-5678.
Crossref
M.M. Szczȩśniak & G. Chałasiński. (1992) Ab initio calculations of nonadditive effects. Journal of Molecular Structure: THEOCHEM 261, pages 37-54.
Crossref
Ashok Kumar & William J. Meath. (1992) Constrained anisotropic dipole oscillator strength distribution techniques, and reliable results for anisotropic and isotropic dipole molecular properties, with applications to H2 and N2. Theoretica Chimica Acta 82:1-2, pages 131-152.
Crossref
Mal/gorzata M. Szczȩśniak, Rick A. Kendall & Grzegorz Chal/asiński. (1991) A b   i n i t i o study of the nonadditive effects in the trimer of ammonia . The Journal of Chemical Physics 95:7, pages 5169-5178.
Crossref
M. M. Szczȩśniak, G. Chal/asiński, S. M. Cybulski & S. Scheiner. (1990) Intermolecular potential of the methane dimer and trimer. The Journal of Chemical Physics 93:6, pages 4243-4253.
Crossref
Piotr Cieplak & Peter Kollman. (1990) Monte Carlo simulation of aqueous solutions of Li+ and Na+ using many-body potentials.  Coordination numbers, ion solvation enthalpies, and the relative free energy of solvation. The Journal of Chemical Physics 92:11, pages 6761-6767.
Crossref
Piotr Cieplak, Peter Kollman & Terry Lybrand. (1990) A new water potential including polarization: Application to gas-phase, liquid, and crystal properties of water. The Journal of Chemical Physics 92:11, pages 6755-6760.
Crossref
William J. Meath & Ashok Kumar. (1990) Reliable isotropic and anisotropic dipolar dispersion energies, evaluated using constrained dipole oscillator strength techniques, with application to interactions involving H2, N2, and the rare gases. International Journal of Quantum Chemistry 38:S24, pages 501-520.
Crossref
Piotr Cieplak, Terry P. Lybrand & Peter A. Kollman. (1987) Calculation of free energy changes in ion–water clusters using nonadditive potentials and the Monte Carlo method. The Journal of Chemical Physics 86:11, pages 6393-6403.
Crossref
James M. Phillips. (1986) Methane adsorbed on graphite. III. The bilayer and trilayer. Physical Review B 34:4, pages 2823-2833.
Crossref
Jonathan A. Yoffe, Gerald M. Maggiora & A. Terry Amos. (1986) Dipole sums and intermolecular interaction coefficients derived from refractive index data. Theoretica Chimica Acta 69:5-6, pages 461-473.
Crossref
Andrzej Leś. (1985) A pseudopotential study of the hydrogen bond in H2O·H2S, H2S·H2S and H2O·H2Se systems. Theoretica Chimica Acta 66:6, pages 375-393.
Crossref
Terry P. Lybrand & Peter A. Kollman. (1985) Water–water and water–ion potential functions including terms for many body effects. The Journal of Chemical Physics 83:6, pages 2923-2933.
Crossref
Ashok Kumar, G. R. G. Fairley & William J. Meath. (1985) Dipole properties, dispersion energy coefficients, and integrated oscillator strengths for SF6 . The Journal of Chemical Physics 83:1, pages 70-77.
Crossref
Foppe Visser & Paul E.S. Wormer. (1985) The non-empirical calculation of second-order molecular properties by means of effective states. II. Effective TDCHF spectra for NO+ CO, CO2, and C2H2. Chemical Physics 92:1, pages 129-140.
Crossref
Ashok Kumar & William J. Meath. (1984) Pseudo-spectral dipole oscillator-strength distributions for SO2, CS2 and OCS and values of some related dipole—dipole and triple-dipole dispersion energy constants. Chemical Physics 91:3, pages 411-418.
Crossref
J.R. Reimers & R.O. Watts. (1984) The structure, thermodynamic properties and infrared spectra of liquid water and ice. Chemical Physics 91:2, pages 201-223.
Crossref
James M. Phillips. (1984) Methane adsorbed on graphite. II. A model of the commensurate-incommensurate transitions. Physical Review B 29:10, pages 5865-5871.
Crossref
James M. Phillips. (1984) Model of the commensurate-incommensurate transitions of C /graphite . Physical Review B 29:8, pages 4821-4823.
Crossref
David Belford & Edwin S. Campbell. (1984) Multibody energy components for clusters of water molecules and ice Ih. The Journal of Chemical Physics 80:7, pages 3288-3296.
Crossref
A. J. Stone. 1984. Molecular Liquids. Molecular Liquids 1 34 .
J.R. Reimers, R.O. Watts & M.L. Klein. (1982) Intermolecular potential functions and the properties of water. Chemical Physics 64:1, pages 95-114.
Crossref
Peter Schuster. (2006) Zwischenmolekulare Kräfte – Ein Beispiel für das Zusammenwirken von Theorie und Experiment. Angewandte Chemie 93:6-7, pages 532-553.
Crossref
Roberto Righini, Kazuo Maki & Michael L. Klein. (1981) An intermolecular potential for methane. Chemical Physics Letters 80:2, pages 301-305.
Crossref
Peter Schuster. (2003) Intermolecular Forces—An Example of Fruitful Cooperation of Theory and Experiment. Angewandte Chemie International Edition in English 20:6-7, pages 546-568.
Crossref
Gerald M. Maggiora, Ralph E. Christoffersen, Jonathan A. Yoffe & J. D. Petke. (2006) DEVELOPMENT OF THEORETICAL METHODOLOGY FOR LARGE MOLECULES*. Annals of the New York Academy of Sciences 367:1, pages 1-16.
Crossref
O. Novaro, S. Castillo, W. Kołos & A. Leś. (2004) Three‐body potential energy terms for methane trimers. International Journal of Quantum Chemistry 19:4, pages 637-648.
Crossref
Kazuo Maki & Michael L. Klein. (1981) Phonon spectra of methane physisorbed on graphite. The Journal of Chemical Physics 74:2, pages 1488-1494.
Crossref
William J. Meath, Daniel J. Margoliash, B. L. Jhanwar, A. Koide & G. D. Zeiss. 1981. Intermolecular Forces. Intermolecular Forces 101 115 .
Gene Lamm & Attila Szabo. (1980) Analytic Coulomb approximations for dynamic multipole polarizabilities and dispersion forces. The Journal of Chemical Physics 72:5, pages 3354-3377.
Crossref
E. Clementi, W. Kołos, G. C. Lie & G. Ranghino. (2004) Nonadditivity of interaction in water trimers. International Journal of Quantum Chemistry 17:3, pages 377-398.
Crossref
Jonathan A. Yoffe. (1980) Hydrocarbon long-range interaction coefficients from point charge model formulae. Theoretica Chimica Acta 55:3, pages 219-224.
Crossref
Michael L. Klein, Ian R. McDonald & Roberto Righini. (1979) Structure and dynamics of associated molecular systems. II. Atom–atom potentials and the properties of ammonia. The Journal of Chemical Physics 71:9, pages 3673-3682.
Crossref
J.A. Yoffe. (1979) Magnetic susceptibilities using point-charge models. Chemical Physics Letters 62:3, pages 547-549.
Crossref
J.A. Yoffe. (1979) Intermolecular interaction coefficients C8 and C10 using point-charge models. Chemical Physics Letters 61:3, pages 593-596.
Crossref
Jonathan A. Yoffe. (1979) Intermolecular interaction coefficients using point charge models. Theoretica Chimica Acta 52:2, pages 155-161.
Crossref
Jonathan A. Yoffe. (1979) Bond and inner shell interaction coefficients for hydrocarbons. Theoretica Chimica Acta 51:2, pages 137-144.
Crossref
Jonathan A. Yoffe. (1979) Electric polarizabilities, magnetic susceptibilities and dispersion coefficients for hydrocarbons. Theoretica Chimica Acta 51:2, pages 107-119.
Crossref

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.