| 7433 - 7445 |
Theoretical Kinetics Analysis for (H) over dot Atom Addition to 1,3-Butadiene and Related Reactions on the (C) over dot(4)H(7) Potential Energy Surface
Li Y, Klippenstein SJ, Zhou CW, Curran HJ |
| 7446 - 7454 |
State-to-State Differential Cross Sections for Inelastic Collisions of NO Radicals with para-H-2 and ortho-D-2
Gao Z, Vogels SN, Besemer M, Karman T, Groenenboom GC, van der Avoird A, van de Meerakker SYT |
| 7455 - 7468 |
Nuclear Spin Symmetry Conservation in (H2O)-H-1-O-16 Investigated by Direct Absorption FTIR Spectroscopy of Water Vapor Cooled Down in Supersonic Expansion
Georges R, Michaut X, Moudens A, Goubet M, Pirali O, Soulard P, Asselin P, Huet T, Roy P, Fournier M, Vigasin A |
| 7469 - 7476 |
Reaction of Methyl Fluoroformyl Peroxycarbonate (FC(O)OOC(O)OCH3) with CI Atoms: Formation of Hydro-ChloroFluoro-Peroxides
Berasategui M, Arguello GA, Paci MAB |
| 7477 - 7493 |
Formation of Hydroxylamine in Low-Temperature Interstellar Model Ices
Tsegaw YA, Gobi S, Forstel M, Maksyutenko P, Sander W, Kaiser RI |
| 7494 - 7502 |
Chemical Dynamics Simulations of Energy Transfer for Propylbenzene Cation and He Collisions
Kim H, Saha B, Pratihar S, Majumder M, Hase WL |
| 7503 - 7510 |
Imaging the Photodissociation Dynamics of Nitrous Acid (HONO): The Role of Torsion
Amarasinghe C, Kamasah A, Foley CD, Thompson JOF, Suits AG |
| 7511 - 7517 |
Nucleation and Growth Kinetics from LaMer Burst Data
Chu DBK, Owen JS, Peters B |
| 7518 - 7523 |
Identifying the Oscillatory Mechanism of the Glucose Oxidase-Catalase Coupled Enzyme System
Muzika F, Jurasek R, Schreiberova L, Radojkovic V, Schreiber I |
| 7524 - 7533 |
Investigation on the Behavior of Noise in Asynchronous Spectra in Generalized Two-Dimensional (2D) Correlation Spectroscopy and Application of Butterworth Filter in the Improvement of Signal-to-Noise Ratio of 2D Asynchronous Spectra
He AQ, Zeng XZ, Xu YZ, Noda I, Ozaki Y, Wu JG |
| 7534 - 7542 |
Interaction of CO2 with Atomic Manganese in the Presence of an Excess Negative Charge Probed by Infrared Spectroscopy of [Mn(CO2)(n)](-) Clusters
Thompson MC, Ramsay J, Weber JM |
| 7543 - 7549 |
Metrics for Molecular Electronic Excitations: A Comparison between Orbital- and Density-Based Descriptors
Savarese M, Guido CA, Bremond E, Ciofini I, Adamo C |
| 7550 - 7564 |
Triplet Excited State of BODIPY Accessed by Charge Recombination and Its Application in Triplet-Triplet Annihilation Upconversion
Chen KP, Yan WB, Wang ZJ, Iagatti A, Bussotti L, Foggi P, Ji W, Zhao JZ, Di Donato M |
| 7565 - 7571 |
Infrared Signature of Structural Isomers of Gas-Phase M+(N2O)(n) (M = Cu, Ag, Au) Ion-Molecule Complexes
Cunningham EM, Gentleman AS, Beardsmore PW, Iskra A, Mackenzie SR |
| 7572 - 7575 |
Driving Force Dependence of Electron Transfer from Electronically Excited [Ir(COD)(mu-Me(2)pz)](2) to Photo-Acid Generators
Sattler W, Rachford AA, LaBeaume PJ, Coley SM, Thackeray JW, Cameron JF, Muller AM, Winkler JR, Gray HB |
| 7576 - 7587 |
Helium Nanodroplet Isolation of the Cyclobutyl, 1-Methylallyl, and Allylcarbinyl Radicals: Infrared Spectroscopy and Ab Initio Computations
Brown AR, Franke PR, Douberly GE |
| 7588 - 7596 |
Influence of Cations on the Fluorescence Quenching of an Ionic, Sterically Congested Pyrenyl Moiety by Iodide in Water
Bertocchi MJ, Lupicki A, Bajpai A, Moorthy JN, Weiss RG |
| 7597 - 7602 |
Infrared Spectroscopy of the Entrance Channel Complex Formed Between the Hydroxyl Radical and Methane in Helium Nanodroplets
Raston PL, Obi EI, Douberly GE |
| 7603 - 7612 |
Infrared Spectroscopic and Theoretical Studies on the OMF2 and OMF (M = Cr, Mo, W) Molecules in Solid Argon
Wei R, Li QN, Gong Y, Andrews L, Fang ZT, Thanthiriwatte KS, Vasiliu M, Dixon DA |
| 7613 - 7618 |
First-Principles Fe L-2,L-3-Edge and O K-Edge XANES and XMCD Spectra for Iron Oxides
Sassi M, Pearce CI, Bagus PS, Arenholz E, Rosso KM |
| 7619 - 7626 |
Effects of Chromophoric Dissolved Organic Matter on Anthracene Photolysis Kinetics in Aqueous Solution and Ice
Malley PPA, Grossman JN, Kahan TF |
| 7627 - 7640 |
Using Fundamental Spectroscopy to Elucidate Kinetic and Energetic Mechanisms within Environmentally Relevant Inductively Coupled Plasma Systems
Hanna AR, Blechle JM, Fisher ER |
| 7641 - 7654 |
Cloud Processing of Secondary Organic Aerosol from Isoprene and Methacrolein Photooxidation
Giorio C, Monod A, Bregonzio-Rozier L, DeWitt HL, Cazaunau M, Temime-Roussel B, Gratien A, Michoud V, Pangui E, Ravier S, Zielinski AT, Tapparo A, Vermeylen R, Claeys M, Voisin D, Kalberer M, Doussin JF |
| 7655 - 7666 |
Modeling Oil Shale Pyrolysis: High-Temperature Unimolecular Decomposition Pathways for Thiophene
Vasiliou AK, Hu H, Cowell TW, Whitman JC, Porterfield J, Parish CA |
| 7667 - 7674 |
The Reaction between Sodium Hydroxide and Atomic Hydrogen in Atmospheric and Flame Chemistry
Martin JCG, Seaton C, de Miranda MP, Plane JMC |
| 7675 - 7683 |
Ab Initio Study of Structural Features and H-Bonding in Alkylammonium-Based Protic Ionic Liquids
Fedorova IV, Krestyaninov MA, Safonova LP |
| 7684 - 7689 |
Can Electron-Rich Oxygen (O2-) Withdraw Electrons from Metal Centers? A DFT Study on Oxoanion-Caged Polyoxometalates
Takazaki A, Eda K, Osakai T, Nakajima T |
| 7690 - 7696 |
Hydrolysis of Dimethyl Methylphosphonate by the Cyclic Tetramer of Zirconium Hydroxide
Schweigert IV, Gunlycke D |
| 7697 - 7708 |
Ab Initio Modeling of Structure and Properties of Single and Mixed Alkali Silicate Glasses
Baral K, Li A, Ching WY |
| 7709 - 7716 |
The trans Effect in Palladium Phosphine Sulfonate Complexes
Rezabal E, Ugalde JM, Frenking G |
| 7717 - 7725 |
Real-Space Bonding Indicator Analysis of the Donor Acceptor Complexes X3BNY3, X(3)AINY(3), X3BPY3, and X(3)AIPY(3) (X, Y = H, Me, CI)
Mebs S, Beckmann J |
| 7726 - 7744 |
Electronic Structures of Small (RuO2)n (n=1-4) Nanoclusters and Their Anions and the Hydrolysis Reactions with Water
Fang ZT, Outlaw MA, Dixon DA |
| 7745 - 7750 |
Study of the Natural Auger Suppression Mechanism in Heterostructures through Heteroboundary Engineering
Slonopas A, Tomkinson D |
| 7751 - 7760 |
Ab Initio Computation of Energy Deposition During Electron Ionization of Molecules
Irikura KK |
| 7761 - 7767 |
Radical-Enhanced Acidity: Why Bicarbonate, Carboxyl, Hydroperoxyl, and Related Radicals Are So Acidic
Walton JC |
| 7768 - 7777 |
Effects of Charge State, Charge Distribution, and Structure on the Ion Mobility of Protein Ions in Helium Gas: Results from Trajectory Method Calculations
Laszlo KJ, Bush MF |
| 7778 - 7786 |
First-Principles Chemical Bonding Study of Manganese Carbodiimide, MnNCN, As Compared to Manganese Oxide, MnO
Nelson R, Konze PM, Dronskowski R |
| 7787 - 7796 |
Computational Investigation of the Geometrical and Electronic Structures of VGen-/0 (n=1-4) Clusters by Density Functional Theory and Multiconfigurational CASSCF/CASPT2 Method
Tran VT, Nguyen MT, Tran QT |
| 7797 - 7806 |
Quantum Chemical Studies on Electron-Accepting Overcrowded Ethylene with a Polarizable Skeleton
Tada T, Fukushima T, Hada M, Majima Y |
