283 - 286 |
Density functional theory studies of correlations between structure, binding energy, and dipole polarizability in Si-9 and Si-12 Zhang DY, Begue D, Pouchan C |
287 - 291 |
Stark quantum defect orbital ionisation thresholds for the n=15-20 states of sodium Menendez JM, Martin I, Velasco AM |
292 - 296 |
Calculation of the optical spectrum of the Ti8C12 and V8C12 Met-Cars Martinez JI, Castro A, Rubio A, Poblet JM, Alonso JA |
297 - 303 |
A reexamination of the chemisorption and desorption of ozone on the exterior of a (5,5) single-walled carbon nanotube Yim WL, Liu ZF |
304 - 307 |
First-principle study on the chromium doping effect on the crystal structure of metallic VO2 Pan M, Zhong HM, Wang SW, Li ZF, Chen XS, Lu W |
308 - 312 |
Ultrafast dynamics of the excitons in a series of axially and bridged substituted phthalocyanine thin films Zhu RY, Chen Y, Zhou J, Li B, Liu WM, Qian SX, Hanack M, Araki Y, Ito O |
313 - 317 |
The nonadiabatic quantum dynamics of the F((2) P-1/2, (2) P-3/2)+HD reaction on modified Alexander, Stark, and Werner potential energy surfaces Xie TX, Zhang Y, Han KL |
318 - 323 |
A class of new 2-D graphical representation of DNA sequences and their application Yao YH, Wang TM |
324 - 329 |
A correlation of spectroscopic parameters from different magnetic resonance spectroscopies for thiazides: a study by NQR, NMR, EPR and DFT methods Latosinska JN |
330 - 335 |
A DFT rationalization of the room temperature photoluminescence of Li2TiSiO5 Orhan E, Albarici VC, Escote MT, Machado MAC, Pizani PS, Leite ER, Sambrano JR, Varela JA, Longo E |
336 - 342 |
Photo-oxidation of lipids by singlet oxygen: a theoretical study Tejero I, Gonzalez-Lafont A, Lluch JM, Eriksson LA |
343 - 350 |
Fluorescent enhancement effect in terbium-gadolinium-protein-cetylpyridine bromide system and its application for the determination of protein at nanogram level Sun CX, Yang JH, Wu X, Su BY, Liu SF |
351 - 356 |
Two-color two-photon REMPI and ZEKE spectroscopy of supersonically cooled o-aminobenzoic acid Wu CY, He YG, Kong W |
357 - 360 |
OBHe+: a remarkably stable singly charged cation containing helium Borocci S, Bronzolino N, Grandinetti F |
361 - 366 |
Toward computation of bulk quadrupolar signals in vibrational sum frequency generation spectroscopy Morita A |
367 - 371 |
Mobility of electrons and holes in a liquid crystalline perylene diimide thin film with time of flight technique Kim JY, Chung IJ, Kim YC, Yu JW |
372 - 376 |
Green upconversion fluorescence in terbium coordination complexes Luo L, Lai WPW, Wong KL, Wong WT, Li KF, Cheah KW |
377 - 383 |
Structural relaxation as a forked road to crystallization and glass transition of vapor-deposited amorphous molecular systems Ishii K, Takei M, Yamamoto M, Nakayama H |
384 - 388 |
Bandwidth of excitons in LH2 bacterial antenna chromoproteins Timpmann K, Trinkunas G, Olsen JD, Hunter CN, Freiberg A |
389 - 392 |
Ultraviolet photoelectron spectra of Tb@C-82 Iwasaki K, Wanita N, Hino S, Yoshimura D, Okazaki T, Shinohara H |
393 - 399 |
Giant electrorheological activity of high surface area mesoporous cerium-doped TiO2 templated by block copolymer Yin JB, Zhao XP |
400 - 406 |
A 40-fs time-resolved absorption study on cis-stilbene in solution: observation of wavepacket motion on the reactive excited state Ishii K, Takeuchi S, Tahara T |
407 - 413 |
Ab initio equation-of-motion coupled-cluster molecular dynamics with'on-the-fly' diabatization: the doublet-like feature in the photoabsorption spectrum of ethylene Choi HC, Baeck KK, Martinez TJ |
414 - 417 |
Mesoporosity in diatoms via surfactant induced silica rearrangement Fowler CE, Hoog Y, Vidal L, Lebeau B |
418 - 421 |
Orientations of two coupled molecules Liao YY, Chen YN, Chuu DS |
422 - 426 |
Paramagnetic relaxation of adamantane radical cation in solution Borovkov VI, Molin YN |
427 - 433 |
Temperature dependence on magnetic field effects on the decay rates of triplet biradical photogenerated from intramolecular electron-transfer in a phenothiazine-C-60 linked compound Moribe S, Yonemura H, Yamada S |
434 - 439 |
Variational reduced-density-matrix theory: strength of Hamiltonian-dependent positivity conditions Gidofalvi G, Mazziotti DA |
440 - 444 |
General features of the polyene references graph-theoretically defined for fullerenes Aihara J, Kanno H |
445 - 448 |
Change in analytic structure of first-order density matrix as a functional of electron density due to inter-particle correlation: a two-electron model example March NH, Rubio A |
449 - 452 |
Electronic structures of InTaO4, a promising photocatalyst Chang HJ, Kong K, Choi YS, In EJ, Choi YM, Baeg JO, Moon SJ |
453 - 458 |
The possibility of selection of molecules embedded in superfluld helium nanodroplets Lokhman VN, Makarov GN |
459 - 465 |
Femtosecond spectroscopy of the hydrated electron: novel features in the infrared Thaller A, Laenen R, Laubereau A |
466 - 470 |
Chemical shifts calculations on aromatic systems: a comparison of models and basis sets Tormena CF, da Silva GVJ |
471 - 475 |
Rotary echoes in nitrogen-14 quadrupolar spin-system Rudakov TN |
476 - 479 |
Quasi-ballistic electron transport in double-wall carbon nanotubes Kajiura H, Huang HJ, Bezryadin A |
480 - 485 |
Thermal transport in liquid and glassy water computed with normal modes Yu X, Leitner DM |
486 - 488 |
A new approach to simulate the depolymerization process of a two-dimensional hexagonal C-60 polymer Lu J, Nagase S, Zhang S, Peng LM |
489 - 494 |
Effect of polymer chain-length polydispersity on the phase behavior of model athermal mixtures of colloids and flexible self-excluding polymers Paricaud P, Varga S, Cummings PT, Jackson G |
495 - 499 |
Nonlinear propagation of ultrashort pulses in cyanine dye solution investigated by SHG FROG Yabushita A, Fuji T, Kobayashi T |
500 - 504 |
Novel luminescent Eu(III) complex with remarkably narrow emission band Nakamura K, Hasegawa Y, Wada Y, Yanagida S |
505 - 510 |
In situ fabrication of dispersed, crystalline platinum nanoparticles embedded in carbon nanofibers Zhang L, Cheng B, Samulski ET |
511 - 516 |
Comparative theoretical study of the mechanisms of generation of rotational strengths in the near-UV in beta-lactamases from class A Karabencheva T, Christov C |
517 - 521 |
NMR measurement of smectic ordering and nematic-smectic-A coupling in a liquid crystal Yethiraj A, Sun ZM, Dong RY, Burnell EE |
522 - 525 |
Backbone dynamics in collagen Aliev AE |
526 - 531 |
Femtosecond time-resolved analysis of the photophysics of the indole molecule Lippert H, Ritze HH, Hertel IV, Radloff W |
532 - 538 |
Direct spectral optimisation of proton-proton homonuclear dipolar decoupling in solid-state NMR Elena B, de Paepe G, Emsley L |
539 - 543 |
The effects of changes in the electronic environment of the 2-aminopyridine-argon van der Waals complex Belcher DE, Cockett MCR |
544 - 552 |
Microwave spectrum of Ne : HBr: structural perspectives on Rg : HX, Rg = Ne, Ar, Kr; X = F, Cl, Br, I Lucchese RR, Bevan JW, Lovas FJ |
553 - 556 |
Chemical reactivity and redox property of Sc-3@C-82 Wakahara T, Sakuraba A, Iiduka Y, Okamura M, Tsuchiya T, Maeda Y, Akasaka T, Okubo S, Kato T, Kobayashi K, Nagase S, Kadish KM |
557 - 559 |
The rate constant of the reaction of H center dot with tert-butyl alcohol in aqueous solution revisited Alam MS, Janata E |
560 - 563 |
The enormous apparent gas-phase acidity of cubylamine Abboud JLM, Alkorta L, Burk P, Davalos JZ, Quintanilla E, Della EW, Koppel MA, Koppel W |
564 - 571 |
Vibrational hot bands of linear C-4 and C-5 arising from a bending vibration with two quanta in the lowest bend: the (v3+2v5)-2v(5) band of C-4 and the (v3+2v(7))-2v(7) band of C-5 Gakwaya S, Abusara Z, Moazzen-Ahmadi N |