431 - 436 |
Chemical potential of quadrupolar two-centre Lennard-Jones fluids by gradual insertion Vrabec J, Kettler M, Hasse H |
437 - 444 |
A transferable interatomic potential for MgO from ab initio molecular dynamics Aguado A, Bernasconi L, Madden PA |
445 - 450 |
Ab initio calculations of NQR Cl-35 frequency in organo-germanium chlorides and its dependency on Ge-O distance Hadipour NL, Rafiee MA, Javaheri M, Mousavie MK |
451 - 456 |
Semiempirical calculations of aniline oligomers hyperpolarisabilities Machado AED, Petrov DV, Falcao EHL, da Gama AAS, de Azevedo WM |
457 - 461 |
Intramolecular character of the intrapair dipolar order relaxation in the methyl deuterated nematic para-azoxyanisole Mensio O, Zamar RC, Casanova F, Pusiol DJ, Dong RY |
462 - 468 |
Density analysis of imaginary part of gamma related to two-photon absorption Nakano M, Fujita H, Takahata M, Yamaguchi K |
469 - 475 |
Identifying structural building blocks in CuO6 clusters: CuO2 complexes vs CuO3 ozonides Pouillon Y, Massobrio C |
476 - 482 |
Direct observation of OH photofragment from triplet hydroxyacetone Chowdhury PK, Upadhyaya HP, Naik PD, Mittal JP |
483 - 489 |
The nature of the Au-Rg bond in the [AuRg(4)](2+) (Rg = Ar, Kr and Xe) molecules Berski S, Latajka Z, Andres J |
490 - 496 |
Ab initio study of reaction of dimethyl sulfoxide (DMSO) with OH radical Wang LM, Zhang JS |
497 - 504 |
Unified representation of MQMAS and STMAS NMR of half-integer quadrupolar nuclei Amoureux JP, Huguenard C, Engelke F, Taulelle F |
505 - 510 |
Reaction of vinyl radical with O-2 studied by time-resolved infrared emission spectroscopy Feng WH, Wang BS |
511 - 514 |
Synthesis of silicon carbide nanowires in a catalyst-assisted process Deng SZ, Wu ZS, Zhou J, Xu NS, Chen R, Chen J |
515 - 522 |
Six-dimensional quantum and classical dynamics study of H-2(nu=0, J=0) scattering from Pd(111) Busnengo HF, Pijper E, Somers MF, Kroes GJ, Salin A, Olsen RA, Lemoine D, Dong W |
523 - 526 |
Theoretical study of C-1 Pi-X-1 Sigma+ transition of InCl Zou WL, Lin MR, Yang XZ, Zhang BZ |
527 - 533 |
Transition between'base' and'tip' carbon nanofiber growth modes Melechko AV, Merkulov VI, Lowndes DH, Guillorn MA, Simpson ML |
534 - 540 |
Hyper-Rayleigh scattering studies of silver, copper, and platinum nanoparticle suspensions Johnson RC, Li JT, Hupp JT, Schatz GC |
541 - 546 |
Excited singlet state relaxation yields of pentacene in Shpol'skii matrices Banasiewicz M, Deperasinska I, Fabjanowicz D, Kozankiewiez B |
547 - 555 |
The first detection of the 3A(g)(-) state in carotenoids using resonance-Raman excitation profiles Furuichi K, Sashima T, Koyama Y |
556 - 562 |
Development of an effective single-electron model of the electronic structure of hydronium and hydronium-water clusters Ermoshin VA, Sobolewski AL, Domcke W |
563 - 566 |
Preparation of monodispersed multi-walled carbon nanotubes in chemical vapor deposition Tang DS, Xie SS, Pan ZW, Sun LF, Liu ZQ, Zou XP, Li YB, Ci LJ, Liu W, Zou BS, Zhou WY |
567 - 572 |
Purification and alignment of arc-synthesis single-walled carbon nanotube bundles Huang HJ, Kajiura H, Yamada A, Ata M |
573 - 576 |
Two-photon-pumped frequency-upconverted yellow lasing in a novel dye solution Tang XJ, Wu LZ, Zhang LP, Tung CH |
577 - 584 |
Remarkably high electrochemical charge uptake for modified electrodes of polyacetylene molecular wires encapsulated within zeolites and mesoporous MCM-41 aluminosilicate Alvaro M, Ferrer B, Garcia H, Lay A, Trinidad F, Valenciano J |
585 - 594 |
On triplet tetraoxygen: ab initio study along minimum energy path and global modelling Varandas AJC, Llanio-Trujillo JL |
595 - 600 |
Metal-free production of high-quality multi-wall carbon nanotubes, in which the innermost nanotubes have a diameter of 0.4 nm Koshio A, Yudasaka M, Iijima S |
601 - 606 |
A density function theory study on the properties and decomposition of CF3OF Yin HM, Sun JL, Li YM, He GZ, Han KL |
607 - 613 |
Third-order optical non-linearities in titanium bis-phthalocyanine/toluene solutions Fernandez-Alonso F, Marovino P, Paoletti AM, Righini M, Rossi G |