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(1999, December) The Journal of Chemical Physics Vol. 111 (22) AIP Publishing

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Reference TypeJournal (issue)
JournalThe Journal of Chemical Physics
Year1999 (December)Volume111
Issue<   22   >
PublisherAIP Publishing
Mindat Ref. ID2249307Long-form Identifiermindat:1:5:2249307:5
GUID0
Full Reference(1999, December) The Journal of Chemical Physics Vol. 111 (22) AIP Publishing
Plain Text(1999, December) The Journal of Chemical Physics Vol. 111 (22) AIP Publishing
In(1999) The Journal of Chemical Physics Vol. 111. AIP Publishing

Contains

Lu, P. H., Polanyi, J. C., Rogers, D. (1999) Electron-induced “localized atomic reaction” (LAR): Chlorobenzene adsorbed on Si(111) 7×7. The Journal of Chemical Physics, 111 (22). 9905-9907 doi:10.1063/1.480325
Naito, M., Tanaka, N., Okamoto, H. (1999) General relationship between complex impedance and linear stability in electrochemical systems. The Journal of Chemical Physics, 111 (22). 9908-9917 doi:10.1063/1.480345
Golosov, Andrei A., Tsonchev, Stefan I., Pechukas, Philip, Friesner, Richard A. (1999) Spin–spin model for two-level system/bath problems: A numerical study. The Journal of Chemical Physics, 111 (22). 9918-9923 doi:10.1063/1.480346
Collins, Michael A., Zhang, Dong H. (1999) Application of interpolated potential energy surfaces to quantum reactive scattering. The Journal of Chemical Physics, 111 (22). 9924-9931 doi:10.1063/1.480344
Battezzati, Michele (1999) A diffusion equation for Brownian motion with arbitrary frictional coefficient: Application to the turnover problem. The Journal of Chemical Physics, 111 (22). 9932-9943 doi:10.1063/1.480343
Chen, Rongqing, Guo, Hua (1999) A single Lanczos propagation method for calculating transition amplitudes. The Journal of Chemical Physics, 111 (22). 9944-9951 doi:10.1063/1.480347
Berezhkovskii, Alexander M., Szabo, Attila, Weiss, George H., Zhou, Huan-Xiang (1999) Reaction dynamics on a thermally fluctuating potential. The Journal of Chemical Physics, 111 (22). 9952-9957 doi:10.1063/1.480348
Kusaka, Isamu, Oxtoby, David W., Wang, Zhen-Gang (1999) On the direct evaluation of the equilibrium distribution of clusters by simulation. The Journal of Chemical Physics, 111 (22). 9958-9964 doi:10.1063/1.480349
Reiss, Howard, Bowles, Richard K. (1999) Comparison between two methods for mapping fluctuations in a simulation cell onto a macrovolume. The Journal of Chemical Physics, 111 (22). 9965-9970 doi:10.1063/1.480350
Snajdr, Martin, Dwyer, Jason R., Rothstein, Stuart M. (1999) Histogram filtering: A technique to optimize wave functions for use in Monte Carlo simulations. The Journal of Chemical Physics, 111 (22). 9971-9981 doi:10.1063/1.480351
Trofimov, A. B., Stelter, G., Schirmer, J. (1999) A consistent third-order propagator method for electronic excitation. The Journal of Chemical Physics, 111 (22). 9982-9999 doi:10.1063/1.480352
Dyall, Kenneth G., Enevoldsen, Thomas (1999) Interfacing relativistic and nonrelativistic methods. III. Atomic 4-spinor expansions and integral approximations. The Journal of Chemical Physics, 111 (22). 10000-10007 doi:10.1063/1.480353
Reichardt, Thomas A., Lucht, Robert P. (1999) Resonant degenerate four-wave mixing spectroscopy of transitions with degenerate energy levels: Saturation and polarization effects. The Journal of Chemical Physics, 111 (22). 10008-10020 doi:10.1063/1.480354
Law, M. M. (1999) Joint local- and normal-mode studies of the overtone spectra of the methyl halides: CH3F, CH3Cl, CH3Br, CD3Br, and CH3I. The Journal of Chemical Physics, 111 (22). 10021-10033 doi:10.1063/1.480355
Fink, Reinhold F., Kivilompolo, Mika, Aksela, Helena (1999) Theory and ab initio calculations of 2p photoabsorption spectra: The lowest Rydberg resonances in HCl. The Journal of Chemical Physics, 111 (22). 10034-10045 doi:10.1063/1.480339
Roberto-Neto, Orlando, Machado, Francisco B. C., Truhlar, Donald G. (1999) Energetic and structural features of the CH4+O(3P)→CH3+OH abstraction reaction: Does perturbation theory from a multiconfiguration reference state (finally) provide a balanced treatment of transition states?. The Journal of Chemical Physics, 111 (22). 10046-10052 doi:10.1063/1.480356
Lee, Hee-Seung, McCoy, Anne B., Harding, Lawrence B., Carter, Christopher C., Miller, Terry A. (1999) An empirical potential energy surface for the Ne–OH/D complexes. The Journal of Chemical Physics, 111 (22). 10053-10060 doi:10.1063/1.480391
Baranowski, R., Thachuk, M. (1999) Molecular-dynamics study of rotational alignment of NO+ drifting in helium—velocity and angular momentum distribution functions. The Journal of Chemical Physics, 111 (22). 10061-10068 doi:10.1063/1.480357
Brudermann, J., Buck, U., Fredj, E., Gerber, R. B., Ratner, M. A. (1999) Vibrational excitation in He+(H2O)11 collisions: Quantum calculations and experiment. The Journal of Chemical Physics, 111 (22). 10069-10076 doi:10.1063/1.480358
Kim, Jongseob, Suh, Seung Bum, Kim, Kwang S. (1999) Water dimer to pentamer with an excess electron: Ab initio study. The Journal of Chemical Physics, 111 (22). 10077-10087 doi:10.1063/1.480326
Yoshizawa, Kazunari, Tachibana, Masamitsu, Yamabe, Tokio (1999) Vibronic interactions in the C36 tri- and tetra-anions. The Journal of Chemical Physics, 111 (22). 10088-10092 doi:10.1063/1.480359
Cheng, Bing-Ming, Chew, Eh Piew, Liu, Chin-Ping, Yu, Jen-Shiang K., Yu, Chin-hui (1999) Photoionization-efficiency spectrum and ionization energy of C2H5SCl. The Journal of Chemical Physics, 111 (22). 10093-10098 doi:10.1063/1.480360
Hättig, Christof, Larsen, Helena, Olsen, Jeppe, Jo/rgensen, Poul, Koch, Henrik, Fernández, Berta, Rizzo, Antonio (1999) The effect of intermolecular interactions on the electric properties of helium and argon. I. Ab initio calculation of the interaction induced polarizability and hyperpolarizability in He2 and Ar2. The Journal of Chemical Physics, 111 (22). 10099-10107 doi:10.1063/1.480361
Koch, Henrik, Hättig, Christof, Larsen, Helena, Olsen, Jeppe, Jo/rgensen, Poul, Fernández, Berta, Rizzo, Antonio (1999) The effect of intermolecular interactions on the electric properties of helium and argon. II. The dielectric, refractivity, Kerr, and hyperpolarizability second virial coefficients. The Journal of Chemical Physics, 111 (22). 10108-10118 doi:10.1063/1.480362
Yang, Seongeun, Kim, Joohyun, Lee, Sangyoub (1999) An efficient Brownian dynamics method for calculating the time-dependent rate coefficients of diffusion-influenced reactions. The Journal of Chemical Physics, 111 (22). 10119-10125 doi:10.1063/1.480363
Makarov, Dmitrii E., Metiu, Horia (1999) Quantum dynamics with dissipation: A treatment of dephasing in the stochastic Schrödinger equation. The Journal of Chemical Physics, 111 (22). 10126-10136 doi:10.1063/1.480390
Makarov, Dmitrii E., Metiu, Horia (1999) Stochastic Schrödinger equation. II. A study of the coherence seen in pump-probe experiments that use a strong pump laser. The Journal of Chemical Physics, 111 (22). 10137-10147 doi:10.1063/1.480364
Lohr, Lawrence L., Miller, Jeremy C., Sharp, Robert R. (1999) Electronic structure and magnetic properties of high-spin octahedral Co(II) complexes: Co(II)(acac)2(H2O)2. The Journal of Chemical Physics, 111 (22). 10148-10158 doi:10.1063/1.480365
Sung, Jaeyoung, Lee, Sangyoub (1999) Relations among the modern theories of diffusion-influenced reactions. I. Reduced distribution function theory versus memory function theory of Yang, Lee, and Shin. The Journal of Chemical Physics, 111 (22). 10159-10170 doi:10.1063/1.480366
Cho, C. H., Urquidi, J., Robinson, G. Wilse (1999) Molecular-level description of temperature and pressure effects on the viscosity of water. The Journal of Chemical Physics, 111 (22). 10171-10176 doi:10.1063/1.480367
Qian, J., Hentschke, R., Heuer, A. (1999) On the origin of dynamic heterogeneities in glass-forming liquids. The Journal of Chemical Physics, 111 (22). 10177-10182 doi:10.1063/1.480368
Consta, Styliani, Kapral, Raymond (1999) Ionization reactions of ion complexes in mesoscopic water clusters. The Journal of Chemical Physics, 111 (22). 10183-10191 doi:10.1063/1.480369
Dahoo, P. R., Lakhlifi, A., Chabbi, H. (1999) Spectroscopy of O3 trapped in rare gas matrices. I. Theoretical model for low-lying vibrational levels. The Journal of Chemical Physics, 111 (22). 10192-10201 doi:10.1063/1.480370
Chabbi, H., Dahoo, P. R., Lakhlifi, A. (1999) Spectroscopy of O3 trapped in rare gas matrices. II. Vibrational energies and transition moments of low-lying levels. The Journal of Chemical Physics, 111 (22). 10202-10209 doi:10.1063/1.480340
Anento, N., Padró, J. A., Canales, M. (1999) Dynamic properties of simple liquids: Dependence on the softness of the potential core. The Journal of Chemical Physics, 111 (22). 10210-10216 doi:10.1063/1.480371
Wissing, K., Barriuso, M. T., Aramburu, J. A., Moreno, M. (1999) Optical excitations and coupling constants in FeO42− and CrO44− complexes in oxides: Density functional study. The Journal of Chemical Physics, 111 (22). 10217-10228 doi:10.1063/1.480372
Yoo, Choong-Shik, Cynn, Hyunchae (1999) Equation of state, phase transition, decomposition of β-HMX (octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine) at high pressures. The Journal of Chemical Physics, 111 (22). 10229-10235 doi:10.1063/1.480341
Modarress, Hamid, Ahmadnia, Ebrahim, Mansoori, G. Ali (1999) Improvement on Lennard-Jones–Devonshire theory for predicting liquid–solid phase transition. The Journal of Chemical Physics, 111 (22). 10236-10241 doi:10.1063/1.480373
Lotz, H. T., Schouten, J. A. (1999) Clathrate hydrates in the system H2O–Ar at pressures and temperatures up to 30 kbar and 140 °C. The Journal of Chemical Physics, 111 (22). 10242-10247 doi:10.1063/1.480342
Huitema, H. E. A., van Hengstum, B., van der Eerden, J. P. (1999) Simulation of crystal growth from Lennard-Jones solutions. The Journal of Chemical Physics, 111 (22). 10248-10260 doi:10.1063/1.480374
Ree, J., Shin, H. K. (1999) Interaction of gas-phase atomic chlorine with a silicon surface: Reactions on bare and hydrogen-chemisorbed surface sites. The Journal of Chemical Physics, 111 (22). 10261-10274 doi:10.1063/1.480375
Fernaud, Maria-Jose, Lomba, Enrique, Lee, Lloyd L. (1999) Chemical potentials and potential distributions of inclusion gas in quenched-annealed random porous media. The Journal of Chemical Physics, 111 (22). 10275-10286 doi:10.1063/1.480376
Wright, Steven, Hasselbrink, Eckart (1999) Photochemistry of disilane adsorbed on a H terminated Si(100) surface. The Journal of Chemical Physics, 111 (22). 10287-10302 doi:10.1063/1.480377
Hillenkamp, Matthias, Pfister, Jörg, Kappes, Manfred M., Webb, Roger P. (1999) Glancing incidence scattering of hyperthermal He+, Xe+, and C60+ from graphite: Angular and velocity distributions of neutrals. The Journal of Chemical Physics, 111 (22). 10303-10313 doi:10.1063/1.480378
Li, W., Haneman, D. (1999) Rupture luminescence from natural fibers. The Journal of Chemical Physics, 111 (22). 10314-10320 doi:10.1063/1.480379
Luty, Tadeusz, Eckhardt, Craig J., Lefebvre, Jacques (1999) Langmuir monolayers as disordered solids: Disorder and elastic fluctuations in mesophases. The Journal of Chemical Physics, 111 (22). 10321-10329 doi:10.1063/1.480380
Tanaka, Shinpei, Ito, Kohzo, Hayakawa, Reinosuke, Ataka, Mitsuo (1999) Size and number density of precrystalline aggregates in lysozyme crystallization process. The Journal of Chemical Physics, 111 (22). 10330-10337 doi:10.1063/1.480381
Bai, Gang, Suzuki, Atsushi (1999) Phase separation of weakly ionized polymer gels during shrinking phase transition. The Journal of Chemical Physics, 111 (22). 10338-10346 doi:10.1063/1.480382
Yoder, G., Dickerson, B. K., Chen, A.-B. (1999) Semiempirical method for calculating structure and band gap of semiconducting polymers. The Journal of Chemical Physics, 111 (22). 10347-10353 doi:10.1063/1.480383
Brabec, C. J., Johansson, H., Cravino, A., Sariciftci, N. S., Comoretto, D., Dellepiane, G., Moggio, I. (1999) The spin signature of charged photoexcitations in carbazolyl substituted polydiacetylene. The Journal of Chemical Physics, 111 (22). 10354-10361 doi:10.1063/1.480384
Curtiss, C. F., Bird, R. Byron (1999) Diffusion-stress relations in polymer mixtures. The Journal of Chemical Physics, 111 (22). 10362-10370 doi:10.1063/1.480385
Muthukumar, M. (1999) Polymer translocation through a hole. The Journal of Chemical Physics, 111 (22). 10371-10374 doi:10.1063/1.480386
Du, Rose, Pande, Vijay S., Grosberg, Alexander Yu., Tanaka, Toyoichi, Shakhnovich, Eugene (1999) On the role of conformational geometry in protein folding. The Journal of Chemical Physics, 111 (22). 10375-10380 doi:10.1063/1.480387
Pépin, M. P., Whitmore, M. D. (1999) Monte Carlo and numerical self-consistent field study of end-tethered polymers in good solvent. The Journal of Chemical Physics, 111 (22). 10381-10388 doi:10.1063/1.480388
Suresh, S. J., Naik, V. M. (1999) A multilayer theory for interfacial properties of systems containing hydrogen bonding molecules. II. A simple, yet exact form for segment potentials arising from association interactions. The Journal of Chemical Physics, 111 (22). 10389-10390 doi:10.1063/1.480389

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