Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.112, No.33 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

7489 - 7491	The photochemistry of formaldehyde: Internal conversion and molecular dissociation in a single step? Araujo M, Lasorne B, Bearpark MJ, Robb MA
7492 - 7497	Geometry optimization of carbon dioxide clusters (CO2)(n) for 4 <= n <= 40 Takeuchi H
7498 - 7506	Vibrational spectroscopy of nitroalkane chains using electron autodetachment and Ar predissociation Schneider H, Vogelhuber KM, Schinle F, Stanton JF, Weber JM
7507 - 7513	Charge separation distance for flexible donor-bridge-acceptor systems after electron-transfer quenching Zhou JW, Lukin LV, Braun CL
7514 - 7529	Ultrafast dynamics and coherent oscillations in ethylene and ethylene-d(4) excited at 162 nm Kosma K, Trushin SA, Fuss W, Schmid WE
7530 - 7542	Elementary peptide motifs in the gas phase: FTIR aggregation study of formamide, acetamide, N-methylformamide, and N-methylacetamide Albrecht M, Rice CA, Suhm MA
7543 - 7550	Isomer populations in liquids for 1-isopropyl-3-methylimidazolium bromide and its iodide and their conformational changes accompanying the crystallizing and melting processes Endo T, Nishikawa K
7551 - 7555	LiSc(BH4)(4): A novel salt of Li+ and discrete Sc(BH4)(4)(-) complex anions Hagemann H, Longhini M, Kaminski JW, Wesolowski TA, Cerny R, Penin N, Sorby MH, Hauback BC, Severa G, Jensen CM
7556 - 7566	Influence of long-chain aliphatic dopants on the spectroscopic properties of polyketimine containing 3,8-diamino-6-phenylphenanthridine and ethylene linkage in the main chain. Noncovalent interaction: Proton transfer, hydrogen and halogen bonding Iwan A, Kaczmarczyk B, Jarzabek B, Jurusik J, Domanski M, Michalak M
7567 - 7576	Proton and water activity-controlled structure formation in zinc carboxylate-based metal organic frameworks Hausdorf S, Wagler J, Mossig R, Mertens FORL
7577 - 7593	Predicted reaction rates of HxNyOz intermediates in the oxidation of hydroxylamine by aqueous nitric acid Ashcraft RW, Raman S, Green WH
7594 - 7599	Matrix isolation infrared spectroscopic and density functional theory studies on the reactions of yttrium and lanthanum hydrides with dinitrogen Teng YL, Xu Q
7600 - 7607	Evaporation loss of dissolved volatile substances from ice surfaces Sato K, Takenaka N, Bandow H, Maeda Y
7608 - 7615	Theoretical explanation of nonexponential OH decay in reactions with benzene and toluene under pseudo-first-order conditions Uc VH, Alvarez-Idaboy JR, Galano A, Vivier-Bunge A
7616 - 7626	Solar-powered electrochemical oxidation of organic compounds coupled with the cathodic production of molecular hydrogen Park H, Vecitis CD, Hoffmann MR
7627 - 7631	Spectroscopic and theoretical study of endohedral dimetallofullerene having a Non-IPR fullerene cage: Ce-2@C-72 Yamada M, Wakahara T, Tsuchiya T, Maeda Y, Akasaka T, Mizorogi N, Nagase S
7632 - 7642	Examining the performance of DFT methods in uranium chemistry: Does core size matter for a pseudopotential? Iche-Tarrat N, Marsden CJ
7643 - 7651	Octacoordinate carbons encaged inside carborane clusters: A density functional theory investigation Wang Y, Huang YH, Yin B, Yang BH, Liu RZ
7652 - 7661	Effect of metal ions (Li+, Na+, K+, Mg2+, Ca2+, Ni2+, Cu2+, and Zn2+) and water coordination on the structure and properties of L-arginine and zwitterionic L-arginine Remko M, Fitz D, Rode BM
7662 - 7670	Study of the thymine molecule: Equilibrium structure from joint analysis of gas-phase electron diffraction and microwave data and assignment of vibrational spectra using results of ab initio calculations Vogt N, Khaikin LS, Grikina OE, Rykov AN, Vogt J
7671 - 7681	In situ polymerization of the 4-vinylbenzenesulfonic anion in Ni-Al-layered double hydroxide and its molecular dynamic simulation Yan DP, Lu J, Wei M, Li H, Ma J, Li F, Evans DG, Duan X
7682 - 7688	The structure of alkali metal derivatives of azoles: N-sigma versus pi structures Blanco F, Alkorta I, Elguero J
7689 - 7698	Theoretical investigations of the reactivities of cationic six-membered carbene analogues of group 14 elements Wang RH, Su MD
7699 - 7704	Structure, energetics, and reactivity of boric acid nanotubes: A molecular tailoring approach Elango M, Subramanian V, Rahalkar AP, Gadre SR, Sathyamurthy N
7705 - 7716	Orbital interpretation of kinetic energy density and a direct space comparison of chemical bonding in tetrahedral network solids Seo DK, Weng CE
7717 - 7722	Molecular structure of the octatetranyl anion, C8H-: A computational study Pichierri F
7723 - 7733	Effects of structural deformations on optical properties of tetrabenzoporphyrins: Free-bases and Pd complexes Lebedev AY, Filatov MA, Cheprakov AV, Vinogradov SA
7734 - 7738	Theoretical study of the stable radicals galvinoxyl, azagalvinoxyl and Wurster's blue perchlorate in the solid state Havenith RWA, de Wijs GA, Attema JJ, Niermann N, Speller S, de Groott RA
7739 - 7744	Impurity effects on small Pd clusters: A relativistic density functional study of Pd4X, X = H, C, O Genest A, Kruger S, Rosch N
7745 - 7749	Influence of chelate ring interactions on copper(II) chelate stability studied by connectivity index functions Milicevic A, Raos N
7750 - 7754	On the destabilization (strain) energy of biphenylene Bachrach SM