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                             55 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 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, Heechol
 2004
 398 4-6 p. 407-413
7 p.
 artikel
2 A class of new 2-D graphical representation of DNA sequences and their application Yao, Yu-hua
 2004
 398 4-6 p. 318-323
6 p.
 artikel
3 A correlation of spectroscopic parameters from different magnetic resonance spectroscopies for thiazides: a study by NQR, NMR, EPR and DFT methods Latosińska, J.N.
 2004
 398 4-6 p. 324-329
6 p.
 artikel
4 A DFT rationalization of the room temperature photoluminescence of Li2TiSiO5 Orhan, E.
 2004
 398 4-6 p. 330-335
6 p.
 artikel
5 A 40-fs time-resolved absorption study on cis-stilbene in solution: observation of wavepacket motion on the reactive excited state Ishii, Kunihiko
 2004
 398 4-6 p. 400-406
7 p.
 artikel
6 A new approach to simulate the depolymerization process of a two-dimensional hexagonal C60 polymer Lu, Jing
 2004
 398 4-6 p. 486-488
3 p.
 artikel
7 A reexamination of the chemisorption and desorption of ozone on the exterior of a (5,5) single-walled carbon nanotube Yim, W.L.
 2004
 398 4-6 p. 297-303
7 p.
 artikel
8 Author Index 2004
 398 4-6 p. 572-581
10 p.
 artikel
9 Backbone dynamics in collagen Aliev, Abil E.
 2004
 398 4-6 p. 522-525
4 p.
 artikel
10 Bandwidth of excitons in LH2 bacterial antenna chromoproteins Timpmann, Kõu
 2004
 398 4-6 p. 384-388
5 p.
 artikel
11 Calculation of the optical spectrum of the Ti8C12 and V8C12 Met-Cars Martínez, J.I.
 2004
 398 4-6 p. 292-296
5 p.
 artikel
12 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, Norman H.
 2004
 398 4-6 p. 445-448
4 p.
 artikel
13 Chemical reactivity and redox property of Sc3@C82 Wakahara, Takatsugu
 2004
 398 4-6 p. 553-556
4 p.
 artikel
14 Chemical shifts calculations on aromatic systems: a comparison of models and basis sets Tormena, Cláudio F.
 2004
 398 4-6 p. 466-470
5 p.
 artikel
15 Comparative theoretical study of the mechanisms of generation of rotational strengths in the near-UV in β-lactamases from class A Karabencheva, Tatyana
 2004
 398 4-6 p. 511-516
6 p.
 artikel
16 Density functional theory studies of correlations between structure, binding energy, and dipole polarizability in Si9 and Si12 Zhang, Daisy Y.
 2004
 398 4-6 p. 283-286
4 p.
 artikel
17 Direct spectral optimisation of proton–proton homonuclear dipolar decoupling in solid-state NMR Elena, Bénédicte
 2004
 398 4-6 p. 532-538
7 p.
 artikel
18 Editorial board 2004
 398 4-6 p. IFC-
1 p.
 artikel
19 Effect of polymer chain-length polydispersity on the phase behavior of model athermal mixtures of colloids and flexible self-excluding polymers Paricaud, Patrice
 2004
 398 4-6 p. 489-494
6 p.
 artikel
20 Electronic structures of InTaO4, a promising photocatalyst Chang, Hyunju
 2004
 398 4-6 p. 449-452
4 p.
 artikel
21 Femtosecond spectroscopy of the hydrated electron: novel features in the infrared Thaller, A.
 2004
 398 4-6 p. 459-465
7 p.
 artikel
22 Femtosecond time-resolved analysis of the photophysics of the indole molecule Lippert, H.
 2004
 398 4-6 p. 526-531
6 p.
 artikel
23 First-principle study on the chromium doping effect on the crystal structure of metallic VO2 Pan, Mei
 2004
 398 4-6 p. 304-307
4 p.
 artikel
24 Fluorescent enhancement effect in terbium–gadolinium–protein–cetylpyridine bromide system and its application for the determination of protein at nanogram level Sun, Changxia
 2004
 398 4-6 p. 343-350
8 p.
 artikel
25 General features of the polyene references graph-theoretically defined for fullerenes Aihara, Jun-ichi
 2004
 398 4-6 p. 440-444
5 p.
 artikel
26 Giant electrorheological activity of high surface area mesoporous cerium-doped TiO2 templated by block copolymer Yin, Jian Bo
 2004
 398 4-6 p. 393-399
7 p.
 artikel
27 Green upconversion fluorescence in terbium coordination complexes Luo, Li
 2004
 398 4-6 p. 372-376
5 p.
 artikel
28 In situ fabrication of dispersed, crystalline platinum nanoparticles embedded in carbon nanofibers Zhang, Lei
 2004
 398 4-6 p. 505-510
6 p.
 artikel
29 Mesoporosity in diatoms via surfactant induced silica rearrangement Fowler, Christabel E.
 2004
 398 4-6 p. 414-417
4 p.
 artikel
30 Microwave spectrum of Ne:HBr: structural perspectives on Rg:HX, Rg=Ne, Ar, Kr; X=F, Cl, Br, I Lucchese, R.R.
 2004
 398 4-6 p. 544-552
9 p.
 artikel
31 Mobility of electrons and holes in a liquid crystalline perylene diimide thin film with time of flight technique Kim, Jung Yong
 2004
 398 4-6 p. 367-371
5 p.
 artikel
32 NMR measurement of smectic ordering and nematic–smectic-A coupling in a liquid crystal Yethiraj, Anand
 2004
 398 4-6 p. 517-521
5 p.
 artikel
33 Nonlinear propagation of ultrashort pulses in cyanine dye solution investigated by SHG FROG Yabushita, Atsushi
 2004
 398 4-6 p. 495-499
5 p.
 artikel
34 Novel luminescent Eu(III) complex with remarkably narrow emission band Nakamura, Kazuki
 2004
 398 4-6 p. 500-504
5 p.
 artikel
35 OBHe+: a remarkably stable singly charged cation containing helium Borocci, Stefano
 2004
 398 4-6 p. 357-360
4 p.
 artikel
36 Orientations of two coupled molecules Liao, Y.Y.
 2004
 398 4-6 p. 418-421
4 p.
 artikel
37 Paramagnetic relaxation of adamantane radical cation in solution Borovkov, V.I.
 2004
 398 4-6 p. 422-426
5 p.
 artikel
38 Photo-oxidation of lipids by singlet oxygen: a theoretical study Tejero, Ismael
 2004
 398 4-6 p. 336-342
7 p.
 artikel
39 Quasi-ballistic electron transport in double-wall carbon nanotubes Kajiura, Hisashi
 2004
 398 4-6 p. 476-479
4 p.
 artikel
40 Rotary echoes in nitrogen-14 quadrupolar spin-system Rudakov, T.N.
 2004
 398 4-6 p. 471-475
5 p.
 artikel
41 Stark quantum defect orbital ionisation thresholds for the n =15–20 states of sodium Menéndez, J.M.
 2004
 398 4-6 p. 287-291
5 p.
 artikel
42 Structural relaxation as a forked road to crystallization and glass transition of vapor-deposited amorphous molecular systems Ishii, Kikujiro
 2004
 398 4-6 p. 377-383
7 p.
 artikel
43 Temperature dependence on magnetic field effects on the decay rates of triplet biradical photogenerated from intramolecular electron-transfer in a phenothiazine-C60 linked compound Moribe, Shinya
 2004
 398 4-6 p. 427-433
7 p.
 artikel
44 The effects of changes in the electronic environment of the 2-aminopyridine–argon van der Waals complex Belcher, David E.
 2004
 398 4-6 p. 539-543
5 p.
 artikel
45 The enormous apparent gas-phase acidity of cubylamine Abboud, José-Luis M.
 2004
 398 4-6 p. 560-563
4 p.
 artikel
46 The nonadiabatic quantum dynamics of the F(2P1/2, 2P3/2)+HD reaction on modified Alexander, Stark, and Werner potential energy surfaces Xie, Ting-Xian
 2004
 398 4-6 p. 313-317
5 p.
 artikel
47 The possibility of selection of molecules embedded in superfluid helium nanodroplets Lokhman, V.N.
 2004
 398 4-6 p. 453-458
6 p.
 artikel
48 The rate constant of the reaction of H with tert-butyl alcohol in aqueous solution revisited Alam, M.S.
 2004
 398 4-6 p. 557-559
3 p.
 artikel
49 Thermal transport in liquid and glassy water computed with normal modes Yu, Xin
 2004
 398 4-6 p. 480-485
6 p.
 artikel
50 Toward computation of bulk quadrupolar signals in vibrational sum frequency generation spectroscopy Morita, Akihiro
 2004
 398 4-6 p. 361-366
6 p.
 artikel
51 Two-color two-photon REMPI and ZEKE spectroscopy of supersonically cooled o-aminobenzoic acid Wu, Chengyin
 2004
 398 4-6 p. 351-356
6 p.
 artikel
52 Ultrafast dynamics of the excitons in a series of axially and bridged substituted phthalocyanine thin films Zhu, Rong-Yi
 2004
 398 4-6 p. 308-312
5 p.
 artikel
53 Ultraviolet photoelectron spectra of Tb@C82 Iwasaki, Kentaro
 2004
 398 4-6 p. 389-392
4 p.
 artikel
54 Variational reduced-density-matrix theory: strength of Hamiltonian-dependent positivity conditions Gidofalvi, Gergely
 2004
 398 4-6 p. 434-439
6 p.
 artikel
55 Vibrational hot bands of linear C4 and C5 arising from a bending vibration with two quanta in the lowest bend: the (ν 3 +2ν 5)−2ν 5 band of C4 and the (ν 3 +2ν 7)−2ν 7 band of C5 Gakwaya, S.
 2004
 398 4-6 p. 564-571
8 p.
 artikel
                             55 gevonden resultaten
 
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