237 - 244 |
Infrared intensities from the MULTIMODE code Burcl R, Carter S, Handy NC |
245 - 250 |
Dependence of crystal field splitting of 5d levels on hosts in the halide crystals Shi JS, Wu ZJ, Zhou SH, Zhang SY |
251 - 257 |
Scaled DFT chemical shieldings Chesnut DB |
258 - 262 |
Substituent effects on steric strain Novak I |
263 - 268 |
Narrow diameter distribution of singlewalled carbon nanotubes grown on Ni-MgO by thermal chemical vapor deposition Jeong HJ, An KH, Lim SC, Park MS, Chang JS, Park SE, Eum SJ, Yang CW, Park CY, Lee YH |
269 - 272 |
Luminescent blinking of gold nanoparticles Geddes CD, Parfenov A, Gryczynski I, Lakowicz JR |
273 - 278 |
Influence of the different Gd/Y ratio on the properties of Nd : YxGd1-xVO4 mixed crystals Qin LJ, Meng XL, Zhu L, Liu JH, Xu BC, Xu HZ, Jiang FY, Du CL, Wang XQ, Shao ZS |
279 - 285 |
Enhanced uptake of giant DNA in cell-sized liposomes Sato Y, Nomura SM, Yoshikawa K |
286 - 291 |
The temperature dependence of the rate constant for the reaction F+C2H6 Persky A |
292 - 297 |
Theoretical study of the Ru+N-2 molecular interaction Colmenares F, Melendez S |
298 - 303 |
Efficiency and stability enhancement in organic light-emitting devices with CsF/Mg : Ag cathode Chan MY, Lai SL, Lee CS, Lee ST |
304 - 312 |
Isomerization pathways of singlet Ga2H2: quantum-mechanical predictions Moc J, Wierzejewska M |
313 - 318 |
Ordered nanoporous nickel films and their magnetic properties Lei Y, Chim WK, Zhang ZP, Zhou TJ, Zhang LD, Meng GW, Phillipp F |
319 - 324 |
Annealing effect on disordered multi-wall carbon nanotubes Kim YA, Hayashi T, Osawa K, Dresselhaus MS, Endo M |
325 - 329 |
Aluminium, not the halogen atom, is the preferred protonation site in AlCl and AlBr Petrie S |
330 - 336 |
First-principles simulations for structures and optical spectra of carbon cluster C-8 Chen XR, Bai YL, Zhou XL, Yang XD |
337 - 341 |
Vibrational levels of p-xylene cation determined by mass-analyzed threshold ionization spectroscopy Zhang B, Aigner U, Selzle HL, Schlag EW |
342 - 346 |
Pressure and temperature induced crystallization of liquid phosphorus under high pressure Morishita T |
347 - 351 |
The effect of hydrogen on the formation of nitrogen-doped carbon nanotubes via catalytic pyrolysis of acetonitrile Yan H, Li QW, Zhang J, Liu ZF |
352 - 358 |
Electroconductivity, electroluminescence spectra, and activation of molten MCl2+KCl (M = Ca, Sr, Ba) in high electric fields Shabanov OM, Gadzhiev SM, Magomedova AO, Dzamalova SA |
359 - 365 |
N-2 chemisorption to W-n(-) nanoclusters: molecular versus dissociative chemisorption Kim YD, Stolcic D, Fischer M, Gantefor G |
366 - 371 |
Electronic structure of titanium oxide nanotubules Hong J, Cao J, Sun JZ, Li HY, Chen HZ, Wang M |
372 - 377 |
Theoretical studies on one-dimensional polymers constructed from D-2d C-36 molecules Du SX, Huang YH, Liu RZ |
378 - 382 |
MO theory of isotope symmetry breaking in HDO and HD Goncalves CP, Mohallem JR |
383 - 390 |
Effect of translational kinetics on chemical rates in a direct simulation Monte Carlo model gas phase detonation Bruno D, Capitelli M, Longo S |
391 - 396 |
Conduction path and disorder in the fast oxide-ion conductor (La0.8Sr0.2)(Ga0.8Mg0.15Co0.05)O-2.8 Yashima M, Nomura K, Kageyama H, Miyazaki Y, Chitose N, Adachi K |
397 - 403 |
A model for the heteropolar bond Magnasco V |
404 - 410 |
Vibrational energy relaxation pathways of water Pakoulev A, Wang ZH, Pang YS, Dlott DD |
411 - 418 |
Ultrafast photodissociation dynamics of the acetone 3s Rydberg state at 195 nm: a new mechanism Chen WK, Ho JW, Cheng PY |
419 - 423 |
Is aluminum a suitable buffer layer for carbon nanotube growth? de los Arcos T, Wu ZM, Oelhafen P |
424 - 434 |
Ab initio study of the influence of conformation on partial charge distribution of dioctadecylamine Huetz P, Ramseyer C, Girardet C |
435 - 443 |
Oxidation of carbon monoxide on small iron clusters Gutsev GL, Bauschlicher CW |
444 - 450 |
Vibrationally assisted DIET through transient temperature rise: the case of benzene on Pt{111} Arnolds H, Levis RJ, King DA |
451 - 455 |
Cs doping and energy level shift in CuPc Gao YL, Yan L |
456 - 463 |
Theoretical investigation on nevirapine and HIV-1 reverse transcriptase binding site interaction, based on ONIOM method Kuno M, Hannongbua S, Morokuma K |
464 - 470 |
An adaptive method for computing resonance fields for continuous-wave EPR spectra Stoll S, Schweiger A |
471 - 479 |
Experimentally observed van der Waals modes and computed structures of benzene-cyclohexane clusters, BCn; n=1-3 Easter DC, Davis KA |
480 - 485 |
Theoretical studies on photophysical properties of fullerene and its two derivatives (C-60, C60COOCH2, C60COOHCH3) Li XD, Cheng WD, Wu DS, Zhang H, Gong YJ, Lan YZ |
486 - 487 |
Comment on'characterizing unpaired electrons from one-particle density matrix' [M. Head-Gordon, Chem. Phys. Lett. 372 (2003) 508-511] Bochicchio RC, Torre A, Lain L |
488 - 489 |
Reply to comment on'characterizing unpaired electrons from the one-particle density matrix' Head-Gordon M |
490 - 490 |
Infrared frequency-modulation measurements of absolute rate coefficients for Cl+HD -> HCl (DCl)+D(H) between 295 and 700 K (vol 306, pg 33, 1999) Taatjes CA |