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                             42 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 A computational study of the water-catalyzed formation of NH2CH2OH Courmier, Delphine
 2005
 405 4-6 p. 357-363
7 p.
 artikel
2 Adsorption thermodynamics of acrolein on Pt (111) in realistic temperature and pressure from first-principle calculations Loffreda, D.
 2005
 405 4-6 p. 434-439
6 p.
 artikel
3 A new fitting law of rovibrationally inelastic rate constants for rapidly rotating molecules Strekalov, M.L.
 2005
 405 4-6 p. 371-375
5 p.
 artikel
4 Anisotropic saturable absorption of single-wall carbon nanotubes aligned in polyvinyl alcohol Rozhin, Aleksey G.
 2005
 405 4-6 p. 288-293
6 p.
 artikel
5 Application of 2D-HYSCORE spectroscopy to tyrosine radicals Y D and Y Z in photosystem II for evaluation of spin density distributions Nakazawa, Shigeaki
 2005
 405 4-6 p. 318-322
5 p.
 artikel
6 A practical approach to determine the handedness of chiral carbon nanotubes by electron diffraction Liu, Zejian
 2005
 405 4-6 p. 265-269
5 p.
 artikel
7 Assessment of recently developed density functional approaches for the evaluation of the bond length alternation in polyacetylene Jacquemin, Denis
 2005
 405 4-6 p. 376-381
6 p.
 artikel
8 Author Index 2005
 405 4-6 p. 465-472
8 p.
 artikel
9 Control of two-dimensional aggregates of a long-chain merocyanine by change of molecular environments in monolayer assemblies Murata, Michio
 2005
 405 4-6 p. 416-421
6 p.
 artikel
10 Crystalline/amorphous Raman markers of hole-transport material NPD in organic light-emitting diodes Sugiyama, Takuro
 2005
 405 4-6 p. 330-333
4 p.
 artikel
11 Deterministic design for Tsallis distribution sampling Fukuda, Ikuo
 2005
 405 4-6 p. 364-370
7 p.
 artikel
12 Editorial board 2005
 405 4-6 p. CO2-
1 p.
 artikel
13 Electron scattering on p-benzoquinone anions El Ghazaly, Mohamed O.A.
 2005
 405 4-6 p. 278-281
4 p.
 artikel
14 Existence of weakly bound states for metal–benzene molecules confirmed from a long-range model Aubert-Frécon, M.
 2005
 405 4-6 p. 422-424
3 p.
 artikel
15 Experimental and QM/MM investigation of the hydrated silica surface reactivity Casarin, Maurizio
 2005
 405 4-6 p. 459-464
6 p.
 artikel
16 Growth and photodissociation of U+(C6H6) n (n =1–3) and UO m + (C6H6) (m =1,2) complexes Pillai, E.D.
 2005
 405 4-6 p. 247-251
5 p.
 artikel
17 g-Tensor calculations of bicyclic 1,3,2-dithiazolyl radicals using the coupled-perturbed Kohn–Sham UB1LYP and UPBE0 hybrid density functionals Mattar, Saba M.
 2005
 405 4-6 p. 382-388
7 p.
 artikel
18 How accurate is time-independent perturbation theory for calculating frequency shifts of diatomic molecules in rare gas fluids? Li, Shenmin
 2005
 405 4-6 p. 304-309
6 p.
 artikel
19 In situ formation of solid-supported lipid/DNA complexes Caracciolo, Giulio
 2005
 405 4-6 p. 252-257
6 p.
 artikel
20 Interaction of bihalogen anions with nitrogen: Matrix-isolation study and first principle calculations of the (ClHCl)−⋯N2 and (BrHBr)−⋯N2 complexes Lignell, Antti
 2005
 405 4-6 p. 448-452
5 p.
 artikel
21 Intercage dynamics of C60 in doped crystals Kemner, Ewout
 2005
 405 4-6 p. 270-273
4 p.
 artikel
22 Intermolecular vibration–vibration energy transfer in solution: Hydrogen fluoride in water Laage, Damien
 2005
 405 4-6 p. 453-458
6 p.
 artikel
23 Lennard-Jones approach to optical zero-phonon spectra of impurities in glasses Renge, Indrek
 2005
 405 4-6 p. 404-409
6 p.
 artikel
24 Local structure dependence of the charge transfer band in nanocrystalline Y2O3:Eu3+ Wang, Ji-Wei
 2005
 405 4-6 p. 314-317
4 p.
 artikel
25 Manipulating headgroups in Langmuir–Blodgett films through subphase pH variation Kundu, S.
 2005
 405 4-6 p. 282-287
6 p.
 artikel
26 Maximizing second hyperpolarizability of single carrier 2D quantum dots: Interplay of strengths of confining potential, magnetic field and anharmonicity Ghosh, Manas
 2005
 405 4-6 p. 410-415
6 p.
 artikel
27 Mixed excitation mechanism in solid-state cathodoluminescence structure Qian, Lei
 2005
 405 4-6 p. 389-392
4 p.
 artikel
28 Optimal oxygen concentration for the detection of single indocarbocyanine molecules in a polymeric matrix Piwoński, H.
 2005
 405 4-6 p. 352-356
5 p.
 artikel
29 Optimizing frequency dispersed transient absorption signals: A computational study Kaiser, A.
 2005
 405 4-6 p. 339-343
5 p.
 artikel
30 Probing resonant nonlinearities in organic materials using photonic-crystal fiber frequency converters Konorov, S.O.
 2005
 405 4-6 p. 310-313
4 p.
 artikel
31 QTAIM study of the electronic structure and strain energy of fluorine substituted oxiranes and thiiranes Vila, Antonio
 2005
 405 4-6 p. 440-447
8 p.
 artikel
32 Quantum chemical computation of the spectroscopic constants of the X ˜ ( 1 A ′ ) , a ˜ ( 3 A ″ ) and A ˜ ( 1 A ″ ) states of CBrCl and its heat of formation Guss, Joseph S.
 2005
 405 4-6 p. 258-264
7 p.
 artikel
33 Quantum wave packet revivals in IR+X-ray pump–probe spectroscopy Guimarães, F.F.
 2005
 405 4-6 p. 398-403
6 p.
 artikel
34 Revealing two-competing processes in carrier dynamics of single-walled carbon nanotube films Long, Yongbing
 2005
 405 4-6 p. 300-303
4 p.
 artikel
35 Self-curl and self-assembly of boric acid clusters Wang, Weizhou
 2005
 405 4-6 p. 425-428
4 p.
 artikel
36 Some aspects of quasi-steady state of nitrogen-14 quadrupolar spin-system Rudakov, T.N.
 2005
 405 4-6 p. 334-338
5 p.
 artikel
37 Spectroscopic characterizations of the mixed Langmuir–Blodgett (LB) films of 2,2′-biquinoline molecules: Evidence of dimer formation Deb, S.
 2005
 405 4-6 p. 323-329
7 p.
 artikel
38 Structural characterization of Y@C82 Feng, Lai
 2005
 405 4-6 p. 274-277
4 p.
 artikel
39 Substitution effects on the visible spectra of 1,4-diNHPh-9,10-anthraquinones Jacquemin, Denis
 2005
 405 4-6 p. 429-433
5 p.
 artikel
40 Temperature-dependent water structure: Ab initio and empirical model predictions Mantz, Yves A.
 2005
 405 4-6 p. 294-299
6 p.
 artikel
41 The role of semiconducting hosts on photoluminescence efficiency of Eu-complex Chowdhury, Paramita Saha
 2005
 405 4-6 p. 393-397
5 p.
 artikel
42 Vibrational spectroscopy and density functional theory study on 1,4-bis[2-(4-pyridyl) ethenyl]-benzene Cheng, Jianbo
 2005
 405 4-6 p. 344-351
8 p.
 artikel
                             42 gevonden resultaten
 
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