169 - 172 |
Single-walled carbon nanotubes with DNA recognition Yang WR, Moghaddam MJ, Taylor S, Bojarski B, Wieczorek L, Herrmann J, McCall MJ |
173 - 177 |
Competition between proton and H-atom transfer: The role of the chromophore environment in the green fluorescent protein Manca C |
178 - 182 |
The fragmentation of ethanol cation under an electric field: An ab initio/RRKM study Lu HF, Li FY, Lin CC, Nagaya K, Chao I, Lin SH |
183 - 189 |
On the insertion mechanism of molecular oxygen into a Pd(II)-H bond. Something to add Chowdhury S, Rivalta I, Russo N, Sicilia E |
190 - 193 |
Is hydrogen capable of playing a central atom role in superhalogen anions? Smuczyniska S, Skurski P |
194 - 198 |
Remarkable suppression of the excited-state double-proton transfer in the 7-azaindole dimer due to substitution of the dimethylamino group studied by electronic spectroscopy in the gas phase Zhang X, Komoto Y, Sakota K, Masayuki N, Shinmyozu T, Nanbu S, Nakano H, Sekiya H |
199 - 204 |
Atmospheric chemistry of trans-CF3CH = CHF: Kinetics of the gas-phase reactions with Cl atoms, OH radicals, and O-3 Sondergaard R, Nielsen OJ, Hurley MD, Wallington TJ, Singh R |
205 - 210 |
Effect of ring annelation on Li+-benzene interaction: A computational study Hassan A, Dinadayalane TC, Leszczynski J |
211 - 215 |
Theoretical designs for triplet ground-state carbenes: A target for experimental studies Gu SY, Su MD |
216 - 221 |
Ionic and neutral mercaptothiocarbonyl: A tandem mass spectrometry and computational study Ramesh V, Reddy PN, Srinivas R, Bhanuprakash K, Vivekananda S |
222 - 226 |
The relaxation of vibrationally excited O-2 molecules by atomic oxygen Esposito F, Capitelli M |
227 - 231 |
IR spectra of phenol(+)-Kr-n cluster cations (n=1,2): Evidence for photoionization-induced pi -> H isomerization Takeda A, Andrei HS, Miyazaki M, Ishiuchi SI, Sakai M, Fujii M, Dopfer O |
232 - 236 |
A density functional and ab initio investigation of the p-aminobenzoic acid molecule Lago AF, Davalos JZ, de Brito AN |
237 - 242 |
Accurate intermolecular ground state potential of the He-BH van der Waals complex Wang ZQ, Gong MY, Feng E, Cui ZF |
243 - 247 |
Phase coexistence in polydisperse mixture of hard-sphere colloidal and flexible chain particles Kalyuzhnyi YV, Cummings PT |
248 - 252 |
The C-O bond dissociation of naphthoxymethyl compounds in the higher triplet excited state using two-color two-laser flash photolysis Cai XC, Yamaji M, Sakamoto M, Fujitsuka M, Majima T |
253 - 257 |
Space-selective precipitation of functional crystals in glass by using a high repetition rate femtosecond laser Dai Y, Zhu B, Qiu JR, Ma HL, Lu B, Yu BK |
258 - 263 |
Photoluminescence and electroluminescence properties of a samarium complex Sm(TTA)(3)phen Deng RP, Yu JB, Zhang HJ, Zhou L, Peng ZP, Li ZF, Guo ZY |
264 - 268 |
The barrier origin on the reaction of CO2+OH- in aqueous solution Iida K, Yokogawa D, Sato H, Sakaki S |
269 - 273 |
Some aspects of spin-locking effect in nitrogen-14 quadrupolar spin-system Rudakov TN |
274 - 279 |
Excited-state dynamics of normal and doubly N-confused type hexaphyrin derivatives studied by time-resolved fluorescence measurements Ryu JH, Ito F, Nagamura T, Nakamura K, Furuta H, Shibata Y, Itoh S |
280 - 283 |
Linear relation between T-H (homogeneous ice nucleation temperature) and T-m (melting temperature) for aqueous solutions of sucrose, trehalose, and maltose Kanno H, Soga M, Kajiwara K |
284 - 288 |
Molecular absorption cross-section and absolute absorptivity in the THz frequency range for the explosives TNT, RDX, HMX, and PETN Fitch MJ, Leahy-Hoppa MR, Ott EW, Osiander R |
289 - 292 |
On the nature of infrared absorbing trapped electron center in low-temperature ice-I-h Shkrob IA |
293 - 297 |
Phase transition and molecular motion of cyclohexane confined in metal-organic framework, IRMOF-1, as studied by H-2 NMR Ueda T, Kurokawa K, Omichi H, Miyakubo K, Eguchi T |
298 - 303 |
Predicting nonlinear optical properties in push-pull molecules based on methyl pyridinium donor and 3-cyano-5,5-dimethyl-2(5H)-furanylidene-propanedinitrile acceptor units using vibrational spectroscopy and density functional theory McGoverin CM, Walsh TJ, Gordon KC, Kay AJ, Woolhouse AD |
304 - 308 |
CO adsorbs upside-down on small PtmAun clusters Wang LC |
309 - 312 |
Intrinsic hyperpolarizability of 3-dicyanomethylene5,5-dimethyl-1-[2-(4-hydroxyphenyl) ethenyl]-cyclohexene nanocrystallites incorporated into the photopolymer matrices Kolev T, Kityk IV, Ebothe J, Sahraoui B |
313 - 318 |
Nanoscopic heterogeneities in adsorption and electron transfer processes of perylene diimide dye on TiO2 nanoparticles studied by single-molecule fluorescence spectroscopy Tachikawa T, Cui SC, Top S, Fujitsuka M, Majima T |
319 - 322 |
The origin of enhanced Ll(0) chemical ordering in Ag-doped FePt nanoparticles Sung YM, Lee MK, Kim KE, Kim TG |
323 - 327 |
On the cleavage process of the N-trifluoromethylsulfonyloxy-1,8-naphthalimide photoacid generator Malval JP, Morlet-Savary F, Allonas X, Fouassier JP, Suzuki S, Takahara S, Yamaoka T |
328 - 332 |
Finite length effects in DNA-wrapped carbon nanotubes Chou SG, Son H, Zheng M, Saito R, Jorio A, Dresselhaus G, Dresselhaus MS |
333 - 336 |
Size-dependent near-field coupling observed from InN nanodots grown on nitrided sapphire Stebounova LV, Romanyuk YE, Dengel RG, Leone SR |
337 - 341 |
Structural and electronic properties of a trimetallic nanoparticle catalyst: Ru5PtSn Gronbeck H, Thomas JM |
342 - 346 |
A simple and green approach for preparation of ZnO2 and ZnO under sunlight irradiation Sun M, Hao WC, Wang CZ, Wang TM |
347 - 351 |
Adsorption structures of thiophene on Si(100)-(2 x 1) studied by scanning tunneling microscopy and density functional theory Isobe N, Shibayama T, Mori Y, Shobatake K, Sawabe K |
352 - 355 |
Polystyrene chains orientation: A rubbed and non-rubbed polymer comparative study Ghorbal A, Ben Arfi R, Bistac S, Brogly M |
356 - 363 |
Aperture, symmetry, isotropy, and compactness analysis and their correlation in spaghetti-like nanostructure dynamics Purqon A, Sugiyama A, Nagao H, Nishikawa K |
364 - 368 |
Conformational sampling of a 40-residue protein consisting of alpha and beta secondary-structure elements in explicit solvent Ikebe J, Kamiya N, Shindo H, Nakamura H, Higo J |
369 - 373 |
New calculation method on the lifetime of the reactive scattering resonance states Wang HY, Lu X, Sun XM, Cai ZT, Feng DC |
374 - 377 |
Electric field-induced quenching of photoluminescence in the MEH-PPV : C60 composite thin film Jin H, Hou YB, Meng XG, Teng F |
378 - 382 |
Structure elucidation of lanthanide complexes by theoretical tools Novel pyrazole-pyridine Tb(111) tripod Freire RO, Vila-Nova SP, Brunet E, Juanes O, Rodriguez-Ubis JC, Alves S |
383 - 388 |
beta-Scission of thioimidoyl radicals (R-1-N-C-center dot=S-R-2): A theoretical scale of radical leaving group ability Guerra D, Fuentealba P, Aizman A, Contreras R |
389 - 397 |
Modification for spin-adapted version of configuration interaction singles with perturbative doubles Mochizuki Y, Tanaka K |
398 - 407 |
Accurate global ab initio potentials at low-cost by correlation scaling and extrapolation to the one-electron basis set limit Varandas AJC |
408 - 413 |
Distribution moments of 2D-graphs as descriptors of DNA sequences Bielinska-Waz D, Nowak W, Waz P, Nandy A, Clark T |
414 - 419 |
Quantal cumulant dynamics 11: An efficient time-reversible integrator Shigeta Y, Miyachi H, Hirao K |
420 - 425 |
Identifying a pair of interacting chromophores by using SVD transformed CIS wave functions Mayer I |
426 - 429 |
Er3+-Yb3+ co-doped silicate glass for optical temperature sensor Li CR, Dong B, Li SF, Song CH |
430 - 434 |
Theoretical study on the mechanism of the CrO2++C2H4 reaction in gas phase Chen XX, Feng XS, Wang YC, Wang T, Liu XL, Zheng XW |
435 - 438 |
Piezo- and thermo-switch investigation of the spin-crossover compound [Fe(PM-BiA)(2)(NCS)(2)] Tanasa R, Stancu A, Letard JF, Codjovi E, Linares J, Varret F |
439 - 442 |
Aromaticity and electronic structure of silabenzenes. Possible existence of a new cluster Si6Li6 Santos JC, Fuentealba P |