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NDRL Radiation Chemistry Data Center |
Recent Papers in Radiation and Photochemistry |
04/21/03 |
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A pulse radiolysis study of coumarin and its derivatives.
Singh, T.S., Madhava Rao, B.S., Mohan, H., Mittal, J.P., J. Photochem.
Photobiol., A 153(1-3): 163-71 (2002).
Reactivity of cyclohexanol CH bonds toward the tert-butylperoxy
radical.
Puchkov, S.V., Buneeva, E.I., Perkel, A.L., Kinet. Catal. (Transl. of Kinet.
Katal.) 43(6): 756-63 (2002).
Product studies and laser flash photolysis of direct and
2,4,6-triphenylpyrylium-zeolite Y photocatalyzed degradation of
fenvalerate.
Sanjuan, A., Aguirre, G., Alvaro, M., Garcia, H., Scaiano, J.C., Chretien,
M.N., Focsaneanu, K.S., Photochem. Photobiol. Sci. 1(12): 955-9
(2002).
Mechanisms of photorelease of carboxylic acids from 1-acyl-7-nitroindolines
in solutions of varying water content.
Morrison, J., Wan, P., Corrie, J.E.T., Papageorgiou, G., Photochem.
Photobiol. Sci. 1(12): 960-9 (2002).
Dynamic Stark effect as a probe of the evolution of geminate electron-hole
pairs in a conjugated polymer - art. no. 233203.
Gulbinas, V., Kananavicius, R., Valkunas, L., Bassler, H., Phys. Rev. B:
Condens. Matter Mater. Phys. 66: 233203 (2002).
Naphthalene in the higher triplet excited state.
Cai, X.C., Hara, M., Kawai, K., Tojo, S., Majima, T., Chem. Commun.
(Cambridge) (2): 222-3 (2003).
One-pot synthesis of 2,5-diethynyl-3,4-dibutylthiophene substituted
multitopic bipyridine ligands: redox and photophysical properties of their
ruthenium(II) complexes.
De Nicola, A., Liu, Y., Schanze, K.S., Ziessel, R., Chem. Commun.
(Cambridge) (2): 288-9 (2003).
Transient Raman observations of heme vibrational dynamics in five-coordinate
iron porphyrins.
Loparo, J.J., Cheatum, C.M., Ondrias, M.R., Simpson, M.C., Chem. Phys.
286(2-3): 353-74 (2003).
The cavity size effect on the fluorescence properties of
4'-dimethylaminoacetophenone complexed with cyclodextrins.
Matsushita, Y., Suzuki, T., Ichimura, T., Hikida, T., Chem. Phys.
286(2-3): 399-407 (2003).
Oxidative splitting of a pyrimidine cyclobutane dimer: A pulse radiolysis
study.
Yan, L.Q., Song, Q.H., Hei, X.M., Guo, Q.X., Lin, W.Z., Chin. J. Chem.
21(1): 16-9 (2003).
The mandelamide keto-enol system in aqueous solution. Generation of the enol
by hydration of phenylcarbamoylcarbene.
Chiang, Y., Guo, H.X., Kresge, A.J., Richard, J.P., Toth, K., J. Am. Chem.
Soc. 125(1): 187-94 (2003).
Photochemical cleavage and release of carboxylic acids from [alpha]-keto
amides.
Ma, C.C., Steinmetz, M.G., Cheng, Q., Jayaraman, V., Org. Lett.
5(1): 71-4 (2003).
Synthesis and photophysics of a linear non-covalently linked
porphyrin-fullerene dyad.
Wilson, S.R., MacMahon, S., Tat, F.T., Jarowski, P.D., Schuster, D.I., Chem.
Commun. (Cambridge) (2): 226-7 (2003).
The HOO complex with SO2, a matrix isolation study.
Svensson, T., Nelander, B., Chem. Phys. 286(2-3): 347-52
(2003).
Vibrationally resolved fluorescence excited with submolecular
precision.
Qiu, X.H., Nazin, G.V., Ho, W., Science (Washington, DC, U.S.)
299(5606): 542-6 (2003).
Reduction of 1,4-quinone and ubiquinones by hydrogen atom transfer under UVA
irradiation.
Biondi, C., Galeazzi, R., Littarru, G., Greci, L., Free Radical Res.
36(4): 399-404 (2002).
Electron spin-lattice relaxation in radicals containing two methyl groups,
generated by [gamma]-irradiation of polycrystalline solids.
Harbridge, J.R., Eaton, S.S., Eaton, G.R., J. Magn. Reson.
159(2): 195-206 (2002).
Radical anions of fullerene bisadducts: a multifrequency CW-EPR study.
Zoleo, A., Maniero, A.L., Bellinazzi, M., Prato, M., Da Ros, T., Brunel, L.C.,
Brustolon, M., J. Magn. Reson. 159(2): 226-36 (2002).
Photobiological model studies on perester and pyridone tert-butoxyl
radical sources (photo-Fenton-type reagents): 2'-deoxyguanosine modification by
methyl radicals generated through competitive [beta]-cleavage in aqueous
media.
Adam, W., Marquardt, S., Kemmer, D., Saha-Moeller, C.R., Schreier, P.,
Photochem. Photobiol. Sci. 1(8): 609-12 (2002).
Isopestacin, an isobenzofuranone from Pestalotiopsis microspora,
possessing antifungal and antioxidant activities.
Strobel, G., Ford, E., Worapong, J., Harper, J.K., Arif, A.M., Grant, D.M.,
Fung, P.C.W., Chau, R.M.W., Phytochemistry 60(2): 179-83
(2002).
DEPMPO and lipophilic analogs: synthesis and EPR studies.
Clement, J.-L., Frejaville, C., Tordo, P., Res. Chem. Intermed.
28(2-3): 175-90 (2002).
EPR of gamma irradiated single crystal of 2,2-dimethyl succinic acid.
Osmanoglu, S., Baskan, M.H., Guner, T., Z. Naturforsch., A: Phys. Sci.
57(11): 909-11 (2002).
ODMR of the photoexcited triplet state of donor-acceptor complexes of
naphthalene donor with pyromellitic dianhydride, 1,2,4,5-tetracyanobenzene, and
1,3,5-trinitrobenzene acceptors.
Ghosh, S., Stuart, C., Ozarowski, A., Misra, A., Maki, A., Chem. Phys.
Lett. 368(3-4): 495-501 (2003).
Very high-field EPR study of glycyl radical enzymes.
Duboc-Toia, C., Hassan, A.K., Mulliez, E., Ollagnierde-Choudens, S., Fontecave,
M., Leutwein, C., Heider, J., J. Am. Chem. Soc. 125(1): 38-9
(2003).
Oxidative damage to cytosine: Implication for the study of radiation-induced
damage to DNA.
Close, D.M., J. Phys. Chem. B 107(3): 864-7 (2003).
Cationic arylation through photo(sensitised) decomposition of diazonium
salts. Chemoselectivity of triplet phenyl cations.
Milanesi, S., Fagnoni, M., Albini, A., Chem. Commun. (Cambridge) (2):
216-7 (2003).
Laser photolysis studies of endoergonic triplet energy transfer in solution
by observing the carbon-sulfur bond cleavage of triplet-sensitized
naphthylmethyl phenyl sulfide.
Yamaji, M., Wakabayashi, S., Ueda, S., Shizuka, H., Tobita, S., Chem. Phys.
Lett. 368(1-2): 41-8 (2003).
Properties of chrysene in the higher triplet excited state.
Cai, X.C., Hara, M., Kawai, K., Tojo, S., Majima, T., Chem. Phys. Lett.
368(3-4): 365-9 (2003).
Preparation, structure, and photochemistry of
2-disilanyl-1,4-benzoquinones.
Tsutsui, S., Sakamoto, K., Ebata, K., Kabuto, C., Sakurai, H., Bull. Chem.
Soc. Jpn. 75(12): 2661-5 (2002).
Temperature-sensitive photochemical aromatic substitution on
4-nitroanisole.
Klan, P., Ruzicka, R., Heger, D., Literak, J., Kulhanek, P., Loupy, A.,
Photochem. Photobiol. Sci. 1(12): 1012-6 (2002).
Photochemical transformations of
2,2'-(1,2-phenylenedivinylene)dipyrroles.
Basaric, N., Marinic, Z., Visnjevac, A., Kojic-Prodic, B., Griesbeck, A.G.,
Sindler-Kulyk, M., Photochem. Photobiol. Sci. 1(12): 1017-23
(2002).
Photochemical and thermal ligand exchange in a ruthenium(II) complex based
on a scorpionate terpyridine ligand.
Schofield, E.R., Collin, J.P., Gruber, N., Sauvage, J.P., Chem. Commun.
(Cambridge) (2): 188-9 (2003).
Dissociation of excited 3-butenoic acid at 193 nm: observation of two
channel OH formation dynamics by laser-induced fluorescence.
Chowdhury, P.K., Chem. Phys. Lett. 367(3-4): 253-8 (2003).
[60]Fullerene: A versatile photoactive core for dendrimer chemistry.
Nierengarten, J.F., Armaroli, N., Accorsi, G., Rio, Y., Eckert, J.F.,
Chem.--Eur. J. 9(1): 36-41 (2003).
Photochemistry of 2,3-, 4,5-, and 2,7-azepinobenzodioxins: Photochemical
rearrangement of 2,7-azepinobenzodioxin to 2,3- and 4,5-azepinobenzodioxins,
and formation of 2,3-dihydrodibenzodioxin from 2,3- and
4,5-azepinobenzodioxins.
Saito, K., Ono, K., Emoto, Y., Miyanaga, K., Heterocycles 59(1):
265-74 (2003).
Intramolecular photoreaction of thiobarbiturates with an alkenyl or a benzyl
group in their N-alkyl side chain. Regioselective synthesis of
ring-fused pyrimidine derivatives through photocyclization of mono- and
dithiobarbiturates.
Takechi, H., Takahashi, H., Mahara, R., Machida, M., Heterocycles
59(1): 303-16 (2003).
Photochemistry of nitrogen-containing thiocarbonyl compounds.
Sakamoto, M., Nishio, T., Heterocycles 59(1): 399-427 (2003).
Intermolecular photoreaction benzenecarbothioamide with [beta]-ionone.
Oda, K., Nakagami, R., Haneda, M., Nishizono, N., Machida, M.,
Heterocycles 59(1): 67-70 (2003).
Light-induced metastable linkage isomers of ruthenium sulfur dioxide
complexes.
Kovalevsky, A.Y., Bagley, K.A., Cole, J.M., Coppens, P., Inorg. Chem.
42(1): 140-7 (2003).
A photoprecursor for difluorocarbene.
He, Y.G., Lemal, D.M., J. Fluorine Chem. 119(1): 75-80 (2003).
Studies on the enantioselective catalysis of photochemically promoted
transformations: ''Sensitizing receptors'' as chiral catalysts.
Cauble, D.F., Lynch, V., Krische, M.J., J. Org. Chem. 68(1):
15-21 (2003).
Deciphering the reaction dynamics underlying optimal control laser
fields.
Daniel, C., Full, J., Gonzalez, L., Lupulescu, C., Manz, J., Merli, A., Vajda,
S., Woste, L., Science (Washington, DC, U.S.) 299(5606): 536-9
(2003).
Novel entry into oxepane-diquinane and oxepane-sterpurane hybrids: synthesis
and photochemistry of 3-oxatricyclo[7.2.2.01,7]tridecenones.
Singh, V., Vedantham, P., Kane, V.V., Polborn, K., Tetrahedron Lett.
44(3): 475-8 (2003).
Regioselective free radical phenylsulfenation of a non-activated d-carbon
atom by the photolysis of alkyl benzenesulfenate.
Petrovic, G., Saicic, R.N., Cekovic, Z., Tetrahedron 59(2):
187-96 (2003).
Radiation damage of silicate glasses doped with Tb3+ and
Eu3+.
Baccaro, S., Cecilia, A., Montecchi, M., Nikl, M., Polato, P., Zanella, G.,
Zannoni, R., J. Non-Cryst. Solids 315(3): 271-5 (2003).
Dose rate effect on bimetallic gold-palladium cluster structure.
Remita, H., Etcheberry, A., Belloni, J., J. Phys. Chem. B 107(1):
31-6 (2003).
1,3-Diastereocontrol in acyclic radical allylations.
Enhohn, E.J., Lavieri, S., Cordova, T., Ghiviriga, I., Tetrahedron Lett.
44(3): 531-4 (2003).
An efficient methodology for the C-C bond forming radical cyclization of
hydrophobic substrates in water: effect of additive on radical reaction in
water.
Nambu, H., Anilkumar, G., Matsugi, M., Kita, Y., Tetrahedron
59(1): 77-85 (2003).
Preparation, characterization and photocatalytic activity of nano-sized
ZnO/SnO2 coupled photocatalysts.
Wang, C., Zhao, J.C., Wang, X.M., Mai, B.X., Sheng, G.Y., Peng, P., Fu, J.M.,
Appl. Catal., B 39(3): 269-79 (2002).
Glucose oxidase catalyses the reduction O2 to
H2O2 in the presence of irradiated TiO2 and
isopropyl alcohol.
Ganadu, M.L., Andreotti, L., Vitali, I., Maldotti, A., Molinari, A., Mura,
G.M., Photochem. Photobiol. Sci. 1(12): 951-4 (2002).
Photodimerisation of enones in a clay microenvironment.
Madhavan, D., Pitchumani, K., Photochem. Photobiol. Sci. 1(12):
991-5 (2002).
Surface photochemistry induced by ultrafast pulses of vacuum ultraviolet
light: Physisorbed oxygen on graphite - art. no. 233405.
Riedel, D., Perdigao, L.M.A., Hernandez-Pozos, J.L., Guo, Q., Palmer, R.E.,
Foord, J.S., Kolasinski, K.W., Phys. Rev. B: Condens. Matter Mater.
Phys. 66: 233405 (2002).
Quantitative determination of OH radical generation and its cytotoxicity
induced by TiO2-UVA treatment.
Uchino, T., Tokunaga, H., Ando, M., Utsumi, H., Toxicol. in Vitro
16(5): 629-35 (2002).
Enantioselectivity of photochemical reactions within polymer
microcapsules.
Ma, L., Wu, L.Z., Zhang, L.P., Tung, C.H., Chin. J. Chem. 21(1):
96-7 (2003).
Ion trap tandem mass spectrometric identification of thiabendazole
phototransformation products on titanium dioxide.
Calza, P., Baudino, S., Aigotti, R., Baiocchi, C., Pelizzetti, E., J.
Chromatogr., A 984(1): 59-66 (2003).
Kinetic studies on the reactivity of triphenylmethyl cations adsorbed on
silica, alumina, and aluminosilicate.
Spange, S., Adolph, S., Walther, R., Zimmermann, Y., J. Phys. Chem. B
107(1): 298-305 (2003).
Sulfur-mediated radical cyclisation reactions on solid support.
Harrowven, D.C., May, P.J., Bradley, M., Tetrahedron Lett. 44(3):
503-6 (2003).
Physicochemical properties of calcium caseinate films cross-linked by
gamma-irradiation.
Lacroix, M., Ressouany, M., Ouattara, B., Yu, H.-L., Mateescu, M.A., Patterson,
G.D., Chem. Eng. Commun. 189(10): 1389-402 (2002).
Dielectric relaxation studies of 100 MeV Ni58 ion irradiated
Kapton-H polyimide film.
Prabhavathi, T., Sridharbabu, Y., Quamara, J.K., Indian J. Pure Appl. Phys. 40(9): 654-9 (2002).
Radiochemical and thermal processes in loaded aromatic polyimide
films.
Kovtunets, V.A., Kupchishin, A.I., Taipova, B.G., Omarbekova, Z., Izv.
Minist. Obraz. Nauki Resp. Kaz., Nats. Akad. Nauk Resp. Kaz., Ser. Khim.
(3): 82-9 (2002).
Effects of gamma radiation on poly(methyl methacrylate)/single-wall nanotube
composites.
O'Rourke-Muisener, P.A., Clayton, L., D'Angelo, J., Harmon, J.P., Sikder, A.K.,
Kumar, A., Cassell, A.M., Meyyappan, M., J. Mater. Res. 17(10):
2507-13 (2002).
Acid catalyst mobility in resist resins.
Stewart, M.D., Tran, H.V., Schmid, G.M., Stachowiak, T.B., Becker, D.J.,
Willson, C.G., J. Vac. Sci. Technol., B 20(6): 2946-52 (2002).
Photochemical hole burning in nanostructured polymers.
Machida, S., Horie, K., Kobunshi Ronbunshu 59(12): 725-33
(2002).
Polymer azobenzene liquid crystal films with nano-second
photoresponse.
Adachi, K., Shishido, A., Tsutsumi, O., Ikeda, T., Kobunshi Ronbunshu
59(12): 767-71 (2002).
Order parameters of the film prepared by photopolymerization of a discotic
mesogen in discotic nematic phase.
Ukon, M., Watanabe, T., Sugino, T., Monobe, H., Shimizu, Y., Kobunshi
Ronbunshu 59(12): 787-91 (2002).
Effect of electron beam and [gamma]-ray irradiation on the curing of epoxy
resin.
Kang, P.H., Park, J.S., Nho, Y.C., Macromol. Res. 10(6): 332-8
(2002).
Direct evidence for singlet-triplet exciton annihilation in [pi]-conjugated
polymers - art. no. 235203.
List, E.J.W., Scherf, U., Mullen, K., Graupner, W., Kim, C.H., Shinar, J.,
Phys. Rev. B 23: 235203 (2002).
Radiation vulcanization of acrylonitrile-butadiene rubber with
polyfunctional monomers.
Yasin, T., Ahmed, S., Yoshii, F., Makuuchi, K., React. Funct. Polym.
53(2-3): 173-81 (2002).
Synthesis of N-(phenyl)maleimide-based photopolymer and its
application to photo-aligning of LC molecules.
Kim, J.Y., Kim, T.H., React. Funct. Polym. 53(2-3): 83-9
(2002).
Hyperbranched acrylated aromatic polyester used as a modifier in UV-curable
epoxy acrylate resins.
Kou, H.G., Asif, A., Shi, W.F., Chin. J. Chem. 21(1): 91-5
(2003).
Synthesis of low molecular weight perfluoro oxymethylene vinyl ethers.
Marchionni, G., De Patto, U., Spataro, G., Tortelli, V., J. Fluorine
Chem. 119(1): 83-8 (2003).
Calibration of cyclohexane solid-solid phase transition thermoporosimetry
and application to the study of crosslinking of elastomers upon aging.
Baba, M., Nedelec, J.M., Lacoste, J., Gardette, J.L., J. Non-Cryst.
Solids 315(3): 228-38 (2003).
Membrane surface modification by plasma-induced polymerization of acrylamide
for improved surface properties and reduced protein fouling.
Wavhal, D.S., Fisher, E.R., Langmuir 19(1): 79-85 (2003).
Photo-cross-linkable PNIPAAm copolymers. 2. Effects of constraint on
temperature and pH-responsive hydrogel layers.
Harmon, M.E., Kuckling, D., Frank, C.W., Macromolecules 36(1):
162-72 (2003).
Kinetic and electron spin resonance analysis of RAFT polymerization of
styrene.
Calitz, F.M., Tonge, M.P., Sanderson, R.D., Macromolecules 36(1):
5-8 (2003).
Photo-DSC cure kinetics of vinyl ester resins II: influence of diluent
concentration.
Scott, T.F., Cook, W.D., Forsythe, J.S., Polymer 44(3): 671-80
(2003).
The effect of gamma irradiation on the pressure dependence of the room
temperature transition in PTFE.
Briscoe, B.J., Mahgerefteh, H., Suga, S., Polymer 44(3): 783-91
(2003).
DNA Damage induced by methylated trivalent arsenicals Is mediated by
reactive oxygen species.
Nesnow, S., Roop, B.C., Lambert, G., Kadiiska, M., Mason, R.P., Cullen, W.R.,
Mass, M.J., Chem. Res. Toxicol. 15(12): 1627-34 (2002).
Characterization of the initial carbon-centered pentadienyl radical and
subsequent radicals in lipid peroxidation: identification via on-line high
performance liquid chromatography/electron spin resonance and mass
spectrometry.
Qian, S.Y., Tomer, K.B., Yue, G.-H., Guo, Q., Kadiiska, M.B., Mason, R.P.,
Free Radical Biol. Med. 33(7): 998-1009 (2002).
Targeting of photooxidative damage on single-stranded DNA representing the
bcr-abl chimeric gene using oligonucleotide-conjugates containing
[Ru(Phen)3]2+-like photosensitiser groups.
Crean, C.W., Kavanagh, Y.T., O'Keeffe, C.M., Lawler, M.P., Stevenson, C.,
Davies, R.J.H., Boyle, P.H., Kelly, J.M., Photochem. Photobiol. Sci.
1(12): 1024-33 (2002).
An artificial antenna complex containing four
Ru(Bpy)32+-type chromophores as light-harvesting
components and a Ru(Bpy)(CN)42- subunit as the energy
trap. A structural motif which resembles the natural photosynthetic
systems.
Loiseau, F., Marzanni, G., Quici, S., Indelli, M.T., Campagna, S., Chem.
Commun. (Cambridge) (2): 286-7 (2003).
Fluoresence quenching of riboflavin in aqueous solution by methionin and
cystein.
Drossler, P., Holzer, W., Penzkofer, A., Hegemann, P., Chem. Phys.
286(2-3): 409-20 (2003).
Modeling of ultrasoft X-ray induced DNA damage using structured higher order
DNA targets.
Bernhardt, P., Friedland, W., Jacob, P., Paretzke, H.G., Int. J. Mass
Spectrom. 223(1-3): 579-97 (2003).
Calculation of electron impact ionization cross sections of DNA using the
Deutsch-Mark and Binary-Encounter-Bethe formalisms.
Bernhardt, P., Paretzke, H.G., Int. J. Mass Spectrom. 223(1-3):
599-611 (2003).
Effects of hydration on the induction of strand breaks, base lesions, and
clustered damage in DNA films by [alpha]-radiation.
Yokoya, A., Cunniffe, S.M.T., Stevens, D.L., O'Neill, P., J. Phys. Chem.
B 107(3): 832-7 (2003).
Ozone enhanced activity of aqueous titanium dioxide suspensions for
photocatalytic oxidation of free cyanide ions.
Hernandez-Alsonso, M.D., Coronado, J.M., Maira, A.J., Soria, J., Loddo, V.,
Augugliaro, V., Appl. Catal., B 39(3): 257-67 (2002).
Combined effect of gamma irradiation, ascorbic acid, and edible coating on
the improvement of microbial and biochemical characteristics of ground
beef.
Ouattara, B., Giroux, M., Smoragiewicz, W., Saucier, L., Lacroix, M., J.
Food Prot. 65(6): 981-7 (2002).
Photocatalytic activity of [gamma]-irradiated TiO2.
Chung, H.-H., Lee, M.-J., Jung, J., Choi, S.-W., J. Ind. Eng. Chem. (Seoul,
Repub. Korea) 8(5): 483-7 (2002).
Prospects for photolithography at 121 nm.
Liberman, V., Rothschild, M., Murphy, P.G., Palmacci, S.T., J. Vac. Sci.
Technol., B 20(6): 2567-73 (2002).
An in vitro systematic spectroscopic examination of the
photostabilities of a random set of commercial sunscreen lotions and their
chemical UVB/UVA active agents.
Serpone, N., Salinaro, A., Emeline, A.V., Horikoshi, S., Hidaka, H., Zhao,
J.C., Photochem. Photobiol. Sci. 1(12): 970-81 (2002).
Studies on the radiation of natural food colorants: Effects of [gamma]-ray
irradiation and electron beam on functions of beet red colorant.
Higashimura, Y., Todoriki, S., Tada, M., Radioisotopes 51(5):
214-8 (2002).
Copolymers from tert-butyl methacrylate and 2-propenyl isocyanate -
polymers for photoresist application.
Ferbitz, J., Mormann, W., Polymer 44(3): 527-33 (2003).
Photoinduced charge-transfer reactions of tricyanoethylene with aromatic
hydrocarbon electron donors. II. Semiempirical studies of
naphthalene-tricyanoethylene exciplex.
Deperasinska, I., Prochorow, J., Acta Phys. Pol., A 102(6):
811-26 (2002).
Secondary organic aerosol - 1. Atmospheric chemical mechanism for production
of molecular constituents - art. no. 4332.
Griffin, R.J., Dabdub, D., Seinfeld, J.H., J. Geophys. Res., [Atmos.]
107(D17): AAC 3-1 - AAC 3-26 (2002).
Secondary organic aerosol - 2. Thermodynamic model for gas/particle
partitioning of molecular constituents - art. no. 4333.
Pun, B.K., Griffin, R.J., Seigneur, C., Seinfeld, J.H., J. Geophys. Res.,
[Atmos.] 107(D17): AAC 4-1 - AAC 4-15 (2002).
Secondary organic aerosol - 3. Urban/regional scale model of size- and
composition-resolved aerosols - art. no. 4334.
Griffin, R.J., Dabdub, D., Kleeman, M.J., Fraser, M.P., Cass, G.R., Seinfeld,
J.H., J. Geophys. Res., [Atmos.] 107(D17): AAC 5-1 - AAC 5-14
(2002).
Low energy barriers of H-atom abstraction from phenols.
Tishchenko, O., Kryachko, E.S., Nguyen, M.T., J. Mol. Struct.
615(1-3): 247-50 (2002).
Fast hydrogen elimination from the
[Ru(PH3)3(CO)(H)2] complex in the first
singlet excited states. A quantum dynamics study.
Torres, L., Gelabert, R., Moreno, M., Lluch, J.M., Chem. Phys.
286(2-3): 149-63 (2003).
Excitation energies of molecules by time-dependent density functional theory
based on effective exact exchange Kohn-Sham-potentials.
Della-Sala, F., Gorling, A., Int. J. Quantum Chem. 91(2): 131-8
(2003).
Optical excitations of Si by time-dependent density functional theory based
on exact-exchange Kohn-Sham band structure.
Kim, Y.H., Stadele, M., Gorling, A., Int. J. Quantum Chem. 91(2):
257-62 (2003).
Density functional study of nitroprusside: Mechanism of the photochemical
formation and deactivation of the metastable states.
Buchs, M., Daul, C.A., Manoharan, P.T., Schlapfer, C.W., Int. J. Quantum
Chem. 91(3): 418-31 (2003).
Theoretical studies of isomerization barriers of 2-pentoxy radical and its
products.
Lin, C.Y., Ho, J.J., Int. J. Quantum Chem. 91(3): 461-6 (2003).
Application of molecular cluster models to study the amino acid L-[alpha]-alanine
and its derived radicals in the crystalline state.
Pauwels, E., Van Speybroeck, V., Waroquier, M., Int. J. Quantum Chem.
91(3): 511-6 (2003).
First-principles study on the electronic structure and the ferromagnetic
properties of the organic radical DTDA.
Yao, K.L., Luo, S.J., Liu, Z.L., Phys. B (Amsterdam, Neth.)
325(1-4): 380-4 (2003).
Features of the potential energy surface for the reaction of OH radical with
acetone.
Henon, E., Canneaux, S., Bohr, F., Dobe, S., Phys. Chem. Chem. Phys.
5(2): 333-41 (2003).
Misrepair of radiation-induced DNA double-strand breaks and its relevance
for tumorigenesis and cancer treatment.
Rothkamm, K., Loebrich, M., Int. J. Oncol. 21(2): 433-40
(2002).
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