307 - 313 |
Velocity- and mass-resolved REMPI spectroscopy of van der Waals molecules. A technique for determining the cluster size responsible for spectral features Sampson RK, Bellm SM, Gascooke JR, Lawrance WD |
314 - 319 |
Contributions of steady heat conduction to the rate of chemical reaction Kim HD, Hayakawa H |
320 - 324 |
A soft X-ray absorption study of nanodiamond films prepared by hot-filament chemical vapor deposition Tang YH, Zhou XT, Hu YF, Lee CS, Lee ST, Sham TK |
325 - 330 |
Xe-129 chemical shift measurements on a single crystal surface Jansch HJ, Gerhard P, Koch M, Stahl D |
331 - 335 |
The photo-electronic transfer across membrane between C-60 and US nanoparticles Wang LY, Zhang XT, Du ZL, Bai YB, Li TJ |
336 - 341 |
The surface decoration and electrochemical hydrogen storage of carbon nanofibers Yan XQ, Gao XP, Li Y, Liu ZQ, Wu F, Shen YT, Song DY |
342 - 347 |
Fragment molecular orbital method: application to molecular dynamics simulation,'ab initio FMO-MD' Komeiji Y, Nakano T, Fukuzawa K, Ueno Y, Inadomi Y, Nemoto T, Uebaysai M, Fedorov DG, Kitaura K |
348 - 354 |
Theoretical study of nonadiabatic transitions in the photodissociation of Cl-2 and Br-2 Asano Y, Yabushita S |
355 - 361 |
Ab initio study on the ground and low-lying excited states of GaH Yang XZ, Lin MR, Zou WL, Zhang BZ |
362 - 367 |
Comparison of the T-1 and D-1 diagnostics for electronic structure theory: a new definition for the open-shell D-1 diagnostic Lee TJ |
368 - 372 |
Ultraviolet light-induced spectral change in cubic nanocrystalline Y2O3 : Eu3+ Song HW, Chen BJ, Sun BJ, Zhang JS, Lu SZ |
373 - 376 |
Bulk modulus of solid deuterium at 15 K Kawamura H, Akahama Y, Ohishi Y, Shimomura O, Takemura K |
377 - 385 |
Sternheimer shieldings and EFG polarizabilities: a density-functional theory study Rizzo A, Ruud K, Helgaker T, Salek P, Agren H, Vahtras O |
386 - 393 |
Two-photon absorption properties of symmetric substituted diacetylene: drastic enhancement of the cross section near the one-photon absorption peak Kamada K, Ohta K, Yoichiro I, Kondo K |
394 - 398 |
Metal-doped germanium clusters MGe(n)s at the sizes of n = 12 and 10: divergence of growth patterns from the MSin clusters Lu J, Nagase S |
399 - 402 |
Continuous carbon nanotube production in underwater AC electric arc Biro LP, Horvath ZE, Szalmas L, Kertesz K, Weber F, Juhasz G, Radnoczi G, Gyulai J |
403 - 408 |
Electron-vibrational relaxation of photoexcited polyfluorenes in the presence of chemical defects: A theoretical study Franco I, Tretiak S |
409 - 414 |
Effects of metallic silver particles on the emission properties of [Ru(bpy)(3)](2+) Gryczynski I, Malicka J, Holder E, DiCesare N, Lakowicz JR |
415 - 418 |
Spatially selective electrochemical deposition of composite films of metal and luminescent Si nanoparticles Smith A, Belomoin G, Nayfeh MH, Nayfeh T |
419 - 422 |
Contribution of hydrogen bonding to the slow diffusion of transient radicals Okamoto K, Nogami Y, Tominaga T, Terazima M |
423 - 431 |
Dynamical analysis of tRNA(Gln)-GlnRS complex using normal mode calculation Nakamura S, Ikeguchi M, Shimizu K |
432 - 437 |
DNA interaction with single-walled carbon nanotubes: a SEIRA study Dovbeshko GI, Repnytska OP, Obraztsova ED, Shtogun YV |
438 - 442 |
Experimental study of the second-order non-linear optical properties of tetrathia-[7]-helicene Clays K, Wostyn K, Persoons A, Stefano MB, Maiorana S, Papagni A, Daul CA, Weber V |
443 - 450 |
Rate coefficients for removal of CN(X-2 Sigma(+), v=2) from selected rotational levels between N-i = 0 and 57 in collisions with N-2 and C2H2 Hickson KM, Sadowski CM, Smith IWM |
451 - 454 |
Synthesis and luminescence properties of SnO2 nanoparticles Gu F, Wang SF, Song CF, Lu MK, Qi YX, Zhou GJ, Xu D, Yuan DR |
455 - 463 |
FSO+ and FSO2+ ions from ionised sulfur oxyfluorides: a computational investigation on the structure, stability, and thermochemistry Antoniotti P, Facchini P, Grandinetti F |
464 - 468 |
A stochastic chiral amplification model Todorovic D, Gutman I, Radulovic M |
469 - 475 |
The composition and structures of covalent carbon nitride solids synthesized by solvothermal method Lv Q, Cao CB, Zhang JT, Li C, Zhu HS |
476 - 484 |
Calculations of hydrogen-bond-transmitted indirect nuclear spin-spin couplings: a comparison of density-functional and ab initio methods Pecul M, Sadlej J, Helgaker T |
485 - 488 |
The ion-molecule reaction of O+ with N-2 measured down to 23 K Le Garrec JL, Carles S, Speck T, Mitchell JBA, Rowe BR, Ferguson EE |
489 - 496 |
Intramolecular noncovalent force in cyclic amidines: nonbonded interaction between carbon atoms and heteroatoms Qian XH, Xu XY, Li ZB, Frontera A |
497 - 502 |
Surface-enhanced Raman of Z-vibration mode in single-walled and multi-walled carbon nanotube Zhang X, Zhang W, Liu L, Shen ZX |
503 - 507 |
Analysis of isotope effect of hydrogen-absorbing Pd ultra-fine particle by X-ray powder diffraction and first principle multi-component MO calculation Ishimoto T, Tachikawa M, Yamauchi M, Kitagawa H, Tokiwa H, Nagashima U |
508 - 511 |
Characterizing unpaired electrons from the one-particle density matrix Head-Gordon M |
512 - 518 |
Sc-2 dimer in IPR-violated C-66 fullerene: a covalent bonded metallofullerene Takata M, Nishibori E, Sakata M, Wang CR, Shinohara H |
519 - 523 |
A theoretical study of spin-orbit coupling in an Fe(II) spin-crossover complex. Mechanism of the LIESST effect Kondo M, Yoshizawa K |
524 - 528 |
Optical nonlinear properties of metal cluster [PPh4][C-p*WS3(CuBr)(3)(dppm)] Zhu XR, Niu RM, Sun ZR, Zeng HP, Wang ZG, Lang JP |
529 - 537 |
High-correlation methods for-the calculations of the ground (X-1 Sigma(+)) and first low-lying excited (A (3)Sigma(+) and A (1)Sigma(+)) states dipole polarizabilities of NaLi Merawa M, Begue D, Dargelos A |
538 - 547 |
The Kohn-Sham treatment of anions via the localized Hartree-Fock method Weimer M, Della Sala F, Gorling A |
548 - 552 |
Shannon's entropy of proteomic 2D-gel maps Bonchev D, Randic M |
553 - 556 |
A computational study of the novel metastable compound HSKrH McDowell SAC |
557 - 562 |
The infrared spectrum of NO2+: theory Bennett FR, Critchley ADJ, King GC, McNab IR, Shiell RC |
563 - 568 |
Massive enhancement of persistent spectral hole-burning in the R-lines of NaMgAl(oxalate)(3) center dot-9H(2)O : Cr(III) by partial deuteration Riesen H, Hughes JL |
569 - 576 |
Reactions of HOBr+HCl+nH(2)O and HOBr+HBr+nH(2)O Voegele AF, Tautermann CS, Loerting T, Liedl KR |
577 - 582 |
Light emitting devices from blended films of ruthenium(II)bis(2,2'-bipyridine) (4,7-dimethyl-1,10-phenanthroline) complex with poly(N-vinylcarbazole) Yang JH, Gordon KC |
583 - 589 |
Electronic properties of DNA binding site in transcription OmpR family: semiempirical molecular orbital calculations Kurita N, Sengoku Y, Sekino H |
590 - 594 |
Solvothermal synthesis of porous tellurium nanotubes Wei GD, Yuan DB, Lin YH, Nan CW |
595 - 602 |
Surface modifications of carbon nanotube/polyacrylonitrile composite films by proton beams Pirlot C, Mekhalif Z, Fonseca A, Nagy JB, Demortier G, Delhalle J |
603 - 607 |
Carbon nanotube growth enhanced by nitrogen incorporation Kim TY, Lee KR, Eun KY, Oh KH |