The Journal of Chemical Physics, 2002, V 116, N 4, January 22.
TE The size of interstellar nanodiamonds revealed by infrared
spectra of CH on synthetic diamond nanocrystal surfaces
AU C.-F.Chen, C.-C.Wu, C.-L.Cheng, S.-Y.Sheu, and H.-C.Chang
PP 1211-1214
ARTICLES
TE A preconditioned inexact spectral transform method for
calculating resonance energies and widths, as applied to HCO
AU Bill Poirier and Tucker Carrington, Jr.
PP 1215-1227
TE Electronic transitions with quantum trajectories. II
AU Courtney L.Lopreore and Robert E.Wyatt
PP 1228-1238
TE Variational method for solving the contracted Schroedinger
equation through a projection of the N-particle power method
onto the two-particle space
AU David A.Mazziotti
PP 1239-1249
TE Combining multideterminantal wave functions with density
functionals to handle near-degeneracy in atoms and molecules
AU R.Pollet, A.Savin, T.Leininger, and H.Stoll
PP 1250-1258
TE Linear response coupled cluster calculation of Raman scattering
cross sections
AU Magdalena Pecul and Antonio Rizzo
PP 1259-1268
TE Finite-basis-set optimized effective potential exchange-only method
AU Stanislav Ivanov, So Hirata, and Rodney J.Bartlett
PP 1269-1276
TE Solvable model of kinetic control
AU Simon J.Fraser
PP 1277-1285
TE Alignment in angular distribution of photofragments in
multiphoton above threshold dissociation of HD^{+} by linearly
and circularly polarized intense laser fields
AU Sanjay Sen, Swaralipi Ghosh, S.S.Bhattacharyya, and Samir Saha
PP 1286-1295
TE High-level theoretical study of the conformational equilibrium
of n-pentane
AU A.Salam and M.S.Deleuze
PP 1296-1302
TE Ab initio potential energy surfaces of the propane dimer
AU Jukka-Pekka Jalkanen, Riina Mahlanen, Tapani A.Pakkanen,
and Richard L.Rowley
PP 1303-1312
TE Rotationally resolved spectroscopy of Pt_{2}
AU Marc B.Airola and Michael D.Morse
PP 1313-1317
TE Stripping dynamics in the reactions of electronically excited
carbon atoms, C(^{1}D), with ethylene and propylene-production
of propargyl and methylpropargyl radicals
AU R.I.Kaiser, T.L.Nguyen, A.M.Mebel, and Y.T.Lee
PP 1318-1324
TE Focusing and selecting the linear type HBr-N_{2}O by using a 2 m
long electrostatic hexapole field
AU A.Okano, H.Ohoyama, and T.Kasai
PP 1325-1329
TE Electronic structure and chemical boning in nonstoichiometric
molecules: Al_{3}X_{2}^{-}(X=C,Si,Ge). A photoelectron
spectroscopy and ab initio study
AU Xi Li, Lai-Sheng Wang, Nathan A.Cannon, and Alexander I.Boldyrev
PP 1330-1338
TE Structure and growth modes of (BaO)_{n} (n<=9) clusters
AU G.Chen, Z.F.Liu, and X.G.Gong
PP 1339-1342
TE Caging of Ni clusters by benzene molecules and its effect on the
magnetism of Ni clusters
AU B.K.Rao and P.Jena
PP 1343-1349
TE Optimization of wave packet coefficients in Li_{2} using an
evolutionary algorithm: The role of resonant and nonresonant wavelengths
AU Joshua B.Ballard, Hans U.Stauffer, Zohar Amitay, and Stephen R.Leone
PP 1350-1360
TE Collision-induced electronic energy transfer from v=0 of the
E(0_{g}^{+}) ion-pair state in I_{2}: Collisions with He and Ar
AU Christopher J.Fecko, Miriam A.Freedman, and Thomas A.Stephenson
PP 1361-1369
TE Optical dephasing effects in broadband four-wave mixing in
C_{2}: Implications for broadband FWM thermometry
AU G.M.Lloyd and P.Ewart
PP 1370-1379
TE Low-energy electron collisions with tetrafluoroethene, C_{2}F_{4}
AU C.Winstead and V.McKoy
PP 1380-1387
TE Vibrationally-rotationally inelastic cross sections for H+SiO collisions
AU Alexander P.Palov, Pedro Jimeno, Malcolm D.Gray, David Field,
and G.G.Balint-Kurti
PP 1388-1396
TE Intermolecular potential and second virial coefficient of the
water-helium complex
AU Matthew P.Hodges, Richard J.Wheatley, and Allan H.Harvey
PP 1397-1405
TE Intramolecular energy flow and nonadiabaticity in vibrationally
mediated chemistry: Wave packet studies of Cl+H_{2}O
AU Joanna R.Fair, Doug Schaefer, Ronnie Kosloff, and David J.Nesbitt
PP 1406-1416
TE The ground state of germylidene (H_{2}C==Ge)
AU David A.Hostutler, Dennis J.Clouthier, and Steven W.Pauls
PP 1417-1423
TE Electric field gradients of water: A systematic investigation of
basis set, electron correlation, and rovibrational effects
AU Lars Olsen, Ove Christiansen, Lars Hemmingsen,
Stephan P.A.Sauer, and Kurt V.Mikkelsen
PP 1424-1434
TE A K-dependent adiabatic approximation to the Renner-Teller
effect for triatomic molecules
AU Hua-Gen Yu, James T.Muckerman, and Trevor J.Sears
PP 1435-1442
TE Ultrafast photodissociation dynamics and energetics of the
electronically excited H atom transfer state of the ammonia
dimer and trimer
AU P.Farmanara, H.-H.Ritze, V.Stert, W.Radloff, and I.V.Hertel
PP 1443-1456
TE Dynamics of O(^{3}P_{j})+Rg collisions on ab initio and
scattering potentials
AU Roman V.Krems, A.A.Buchachenko, M.M.Szczesniak, J.Klos, and G.Chalasinski
PP 1457-1467
TE Parametrized direct dynamics study of rate constants of H with
CH_{4} from 250 to 2400 K
AU Jingzhi Pu and Donald G.Truhlar
PP 1468-1478
TE Development of transferable interaction models for water. I.
Prominent features of the water dimer potential energy surface
AU Christian J.Burnham and Sotiris S.Xantheas
PP 1479-1492
TE Development of transferable interaction models for water. II.
Accurate energetics of the first few water clusters from first principles
AU Sotiris S.Xantheas, Christian J.Burnham, and Robert J.Harrison
PP 1493-1499
TE Development of transferable interaction models for water. III.
Reparametrization of an all-atom polarizable rigid model
(TTM2-R) from first principles
AU Christian J.Burnham and Sotiris S.Xantheas
PP 1500-1510
TE Sub-femtosecond dynamics and dissociation of C-H bonds in solid
polystyrene and liquid benzene
AU C.A.Chatzidimitriou-Dreismann, T.Abdul-Redah, R.M.F.Streffer,
and J.Mayers
PP 1511-1518
TE Phase-separation dynamics of a ternary mixture coupled with
reversible chemical reaction
AU Chaohui Tong and Yuliang Yang
PP 1519-1529
TE On the applicability of the Redfield high-temperature theory for
proton dipolar order relaxation in liquid crystals
AU O.Mensio, C.E.Gonzalez, and R.C.Zamar
PP 1530-1535
TE Theoretical study of Cu-Au nanoalloy clusters using a genetic
algorithm
AU Sarah Darby, Thomas V.Mortimer-Jones, Roy L.Johnston,
and Christopher Roberts
PP 1536-1550
TE Quadrupolar-shielding cross-correlations in solid state nuclear
magnetic resonance: Detecting antisymmetric components in
chemical shift tensors
AU Sungsool Wi and Lucio Frydman
PP 1551-1561
TE Time-resolved vibrational optical activity measurement by the
infrared-visible sum-frequency-generation with circularly
polarized infrared light
AU Minhaeng Cho
PP 1562-1570
TE Higher-order hydrodynamics: Extended Fick's Law, evolution
equation, and Bobylev's instability
AU David Jou, Jose Casas-Vazquez, Justino R.Madureira,
Aurea R.Vasconcellos, and Roberto Luzzi
PP 1571-1584
TE Theoretical studies of ligand-free cadmium selenide and related
semiconductor clusters
AU Peter Deglmann, Reinhart Ahlrichs, and Kakha Tsereteli
PP 1585-1597
TE Orientational dynamics of the glass forming liquid,
dibutylphthalate: Time domain experiments and comparison to mode
coupling theory
AU David D.Brace, S.D.Gottke, H.Cang, and M.D.Fayer
PP 1598-1606
TE N_{2} and CO_{2} vibrational modes in solid nitrogen under pressure
AU M.D.McCluskey and K.K.Zhuravlev
PP 1607-1612
TE A theoretical study of liquid alcohols using averaged solvent
electrostatic potentials obtained from molecular dynamics
simulations: Methanol, ethanol and propanol
AU M.E.Martin, M.L.Sanchez, F.J.Olivares del Valle, and M.A.Aguilar
PP 1613-1620
TE On quantum effects near the liquid-vapor transition in helium
AU Martin H.Mueser and Erik Luijten
PP 1621-1628
TE Optimization of laser-driven intramolecular hydrogen transfer in
the presence of dephasing
AU Eitan Geva
PP 1629-1635
TE Concentrated aqueous urea solutions: A molecular dynamics study
of different models
AU Franjo Sokolic, Abdenacer Idrissi, and Aurelien Perera
PP 1636-1646
TE Time-dependent optical linewidth in fluctuating environments:
Stochastic models
AU Gregor Diezemann
PP 1647-1657
TE Photoinduced electron transfer from aliphatic amines to coumarin dyes
AU Sanjukta Nad and Haridas Pal
PP 1658-1670
TE Analysis of a dinitro-based molecular device
AU Jorge M.Seminario, Angelica G.Zacarias, and Pedro A.Derosa
PP 1671-1683
TE Surface model and exchange-correlation functional effects on the
description of Pd/alpha-Al_{2}O_{3}(0001)
AU J.R.B.Gomes, F.Illas, N.Cruz Hernandez, J.F.Sanz, A.Wander, and N.M.Harrison
PP 1684-1691
TE Proton transport via coupled surface and bulk diffusion
AU Yuri Georgievskii, Emile S.Medvedev, and Alexei A.Stuchebrukhov
PP 1692-1699
TE Electronic structure of poly(9,9-dioctylfluorene) in the
pristine and reduced state
AU G.Greczynski, M.Fahlman, W.R.Salaneck, N.Johansson,
D.A.dos Santos, A.Dkhissi, and J.L.Bredas
PP 1700-1706
TE Wavelength selective excitation of surface oxygen anions on
highly dispersed MgO
AU Oliver Diwald, Martin Sterrer, Erich Knoezinger, Peter V.Sushko,
and Alexander L.Shluger
PP 1707-1712
TE Weak intrinsic charge transfer complexes: A new route for
developing wide spectrum organic photovoltaic cells
AU G.Ruani, C.Fontanini, M.Murgia, and C.Taliani
PP 1713-1719
TE Hindered rotation of H_{2} adsorbed interstitially in nanotube
bundles
AU M.K.Kostov, H.Cheng, R.M.Herman, M.W.Cole, and J.C.Lewis
PP 1720-1724
TE Dissociative electron attachment to C_{2}N_{2} molecules at
surface and in gas phase
AU Z.W.Deng and R.Souda
PP 1725-1730
TE Monte Carlo simulations of star-branched polymers confined
between two walls
AU Piotr Romiszowski and Andrzej Sikorski
PP 1731-1736
TE A photon echo study of two-level systems in polyisobutylene
under high pressure
AU Masashi Yamaguchi, Michael J.McIntire, and Eric.L.Chronister
PP 1737-1743
LETTERS TO THE EDITOR
TE Use of crystal polymorphs for resolving an equilibrium liquid's
state on supercooling to 0 K
AU G.P.Johari
PP 1744-1747
TE Erratum: "The ^{19}F-^{1}H coupling constants transmitted
through covalent, hydrogen bond, and van der Waals interactions"
[J. Chem. Phys., v.115, 5498 (2001)]
AU Magdalena Pecul, Joanna Sadlej, and Jerzy Leszczynski
PP 1748
TE Erratum: "A note on quantum thermodynamic rate theories"
[J. Chem. Phys., v.115, 6876 (2001)]
AU Eli Pollak and Jiushu Shao
PP 1748