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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 76, 1992 - Issue 1
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Original Articles

Magnetic and electrical properties of benzene

Joseph D. Augspurger Department of Chemistry, Indiana University-Purdue University at Indianapolis, 1125 East 38th Street, Indianapolis, Indiana, 46205, U.S.A.
&
Clifford E. Dykstra Department of Chemistry, Indiana University-Purdue University at Indianapolis, 1125 East 38th Street, Indianapolis, Indiana, 46205, U.S.A.
Pages 229-237 | Received 19 Dec 1991, Accepted 09 Jan 1992, Published online: 23 Aug 2006

Citations (34)

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PAOLO LAZZERETTI. (1996) Effects of a static electric field on molecular magnetic properties: an approach using continuous transformation of origin of current density. Molecular Physics 89:1, pages 157-170.
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EdetF. Archibong & AjitJ. Thakkar. (1994) Polarizabilities of aromatic six-membered rings: azines and ‘inorganic benzenes’. Molecular Physics 81:3, pages 557-567.
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M. Grayson & W.T. Raynes. (1994) Electric field effects on the carbon-13 nuclear magnetic shielding in several organic molecules. Molecular Physics 81:3, pages 533-545.
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Articles from other publishers (31)

Antonio Rizzo, Chiara Cappelli, Branislav Jansík, Dan Jonsson, Paweł Sałek, Sonia Coriani, Hans Ågren, David J. D. Wilson, Trygve Helgaker, José Miguel Junquera–Hernández, Alfredo M. J. Sánchez de Merás & José Sánchez-Marín. (2008) Erratum: “Density-functional and electron correlated study of five linear birefringences—Kerr, Cotton–Mouton, Buckingham, Jones and magnetoelectric—in gaseous benzene” [J. Chem. Phys. 121, 8814 (2004)]; “Density-functional study of electric and magnetic properties of hexafluorobenzene in the vapor phase” [J. Chem. Phys. 122, 234314 (2005)]; and “A computational study of some electric and magnetic properties of gaseous BF3 and BCl3” [J. Chem. Phys. 123, 114307 (2005)]. The Journal of Chemical Physics 129:3, pages 039901.
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David W.H. Swenson, Heather M. Jaeger & Clifford E. Dykstra. (2006) Clustering of molecular hydrogen around benzene. Chemical Physics 326:2-3, pages 329-334.
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A. Soncini, P.W. Fowler & F. Zerbetto. (2005) Electric-field perturbations of ring currents in π systems. Chemical Physics Letters 405:1-3, pages 136-141.
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Antonio Rizzo, Chiara Cappelli, Branislav Jansı́k, Dan Jonsson, Paweł Sałek, Sonia Coriani & Hans Ågren. (2004) Density-functional and electron correlated study of five linear birefringences—Kerr, Cotton–Mouton, Buckingham, Jones, and magnetoelectric—in gaseous benzene. The Journal of Chemical Physics 121:18, pages 8814-8830.
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Thomas Bondo Pedersen, Alfredo M. J. Sánchez de Merás & Henrik Koch. (2004) Polarizability and optical rotation calculated from the approximate coupled cluster singles and doubles CC2 linear response theory using Cholesky decompositions. The Journal of Chemical Physics 120:19, pages 8887-8897.
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C.E. Dykstra. (2001) Intermolecular electrical response. Journal of Molecular Structure: THEOCHEM 573:1-3, pages 63-71.
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Lasse Jensen, Ole H. Schmidt, Kurt V. Mikkelsen & Per-Olof Åstrand. (2000) Static and Frequency-Dependent Polarizability Tensors for Carbon Nanotubes. The Journal of Physical Chemistry B 104:45, pages 10462-10466.
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M.C. Caputo, M.B. Ferraro & C. Ridruejo. (2000) CTOCD-DZ shielding polarizabilities in a set of small molecules: N 2 , H 2 , HF, HCl, HCN and SH 2. Journal of Molecular Structure: THEOCHEM 501-502, pages 407-418.
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C.E Dykstra & J.M Lisy. (2000) Experimental and theoretical challenges in the chemistry of noncovalent intermolecular interaction and clustering. Journal of Molecular Structure: THEOCHEM 500:1-3, pages 375-390.
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P. Lazzeretti. (2000) Ring currents. Progress in Nuclear Magnetic Resonance Spectroscopy 36:1, pages 1-88.
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Kristian O. Sylvester-Hvid, Kurt V. Mikkelsen & Mark A. Ratner. (1999) Refractive Indices of Molecules in Vapor and Liquid:  Calculations on Benzene. The Journal of Physical Chemistry A 103:42, pages 8447-8457.
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M. Okruss, R. Müller & A. Hese. (1999) High-resolution ultraviolet laser spectroscopy on jet-cooled benzene molecules: Ground and excited electronic state polarizabilities determined from static Stark effect measurements. The Journal of Chemical Physics 110:21, pages 10393-10402.
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Kristian O. Sylvester-Hvid, Per-Olof Åstrand, Mark A. Ratner & Kurt V. Mikkelsen. (1999) Frequency-Dependent Molecular Polarizability and Refractive Index:  Are Substituent Contributions Additive?. The Journal of Physical Chemistry A 103:12, pages 1818-1821.
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J. Waschull, Y. Heiner, B. Sumpf & H.-D. Kronfeldt. (1998) Diode Laser Spectroscopy in the 9.8-μm ν14Band of Benzene. Journal of Molecular Spectroscopy 190:1, pages 140-149.
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Salvatore Millefiori & Andrea Alparone. (1998) Ab initio and density functional theory calculations of the dipole polarizabilities of ethene, benzene and naphthalene. Journal of Molecular Structure: THEOCHEM 422:1-3, pages 179-190.
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George L. Heard & Russell J. Boyd. (1997) Density functional theory studies of the quadrupole moments of benzene and naphthalene. Chemical Physics Letters 277:1-3, pages 252-256.
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Jon M. Sorenson, Jonathon K. Gregory & David C. Clary. (1997) The C6H6–(H2O)2 complex: Theoretical predictions of the structure, energetics, and tunneling dynamics. The Journal of Chemical Physics 106:3, pages 849-863.
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Angel C. de Dios. (1996) Ab initio calculations of the NMR chemical shift. Progress in Nuclear Magnetic Resonance Spectroscopy 29:3-4, pages 229-278.
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Jesús Hernández-Trujillo & Alberto Vela. (1996) Molecular Quadrupole Moments for the Series of Fluoro- and Chlorobenzenes. The Journal of Physical Chemistry 100:16, pages 6524-6530.
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P. Lazzeretti, M. Malagoli & R. Zanasi. 2002. Strategies and Applications in Quantum Chemistry. Strategies and Applications in Quantum Chemistry 279 296 .
H. S. Gutowsky, E. Arunan, T. Emilsson, S. L. Tschopp & C. E. Dykstra. (1995) Rotational spectra and structures of the C6H6–HCN dimer and Ar3–HCN tetramer. The Journal of Chemical Physics 103:10, pages 3917-3927.
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Antonio Rizzo, Trygve Helgaker, Kenneth Ruud, Andrzej Barszczewicz, Michal/ Jaszuński & Poul Jo/rgensen. (1995) Electric field dependence of magnetic properties: Multiconfigurational self-consistent field calculations of hypermagnetizabilities and nuclear shielding polarizabilities of N2, C2H2, HCN, and H2O. The Journal of Chemical Physics 102:22, pages 8953-8966.
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David J. Wales, Paul L. A. Popelier & Anthony J. Stone. (1995) Potential energy surfaces of van der Waals complexes of water and hydrogen halides modeled using distributed multipoles. The Journal of Chemical Physics 102:13, pages 5551-5565.
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J.D. Augspurger & C.E. Dykstra. 1995. 1 36 .
Sl/awomir M. Cybulski & David M. Bishop. (1994) Calculations of magnetic properties. V. Electron-correlated hypermagnetizabilities (Cotton–Mouton effect) for H2, N2, HF, and CO. The Journal of Chemical Physics 101:1, pages 424-429.
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Martin Grayson & William T. Raynes. (1994) Electric field effects on proton magnetic shielding in some binary hydrides. Chemical Physics Letters 218:3, pages 270-275.
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Angel C. de Dios & Cynthia J. Jameson. 1994. 1 69 .
Martin Grayson & William T. Raynes. (1993) Electric field effects on the magnetic shielding of first and second row nuclei in some simple molecules. Chemical Physics Letters 214:5, pages 473-480.
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Joseph D. Augspurger, Angel C. deDios, Eric Oldfield & Clifford E. Dykstra. (1993) Computing nuclear magnetic resonance chemical shielding in large systems via multipole shielding polarizabilities. Chemical Physics Letters 213:3-4, pages 211-216.
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Richard F. W. Bader & Todd A. Keith. (1993) Properties of atoms in molecules: Magnetic susceptibilities. The Journal of Chemical Physics 99:5, pages 3683-3693.
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T. D. Klots, T. Emilsson & H. S. Gutowsky. (1992) Rotational spectra, structure, Kr-83 nuclear quadrupole coupling constant, and the dipole moment of the Kr-benzene dimer. The Journal of Chemical Physics 97:8, pages 5335-5340.
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