| 713 - 720 |
Soft X-ray Induced Production of Neutral Fragments in High-Rydberg States at the O 1s Ionization Threshold of the Water Molecule
Kivimaki A, Wasowicz TJ, Richter R |
| 721 - 730 |
Stabilities, Electronic Structures, and Bonding Properties of 20-Electron Transition Metal Complexes (Cp)(2)TMO and their One-Dimensional Sandwich Molecular Wires (Cp = C5H5, C-5(CH3)H-4, C-5(CH3)(5); TM = Cr, Mo, W)
Xu S, Li MY, Pei GR, Zhao P, Zhao XT, Wu GC, Kong CC, Yang ZM, Ehara M, Yang T |
| 731 - 745 |
Charge Transfer Processes for H + H-2(+) Reaction Employing Coupled 3D Wavepacket Approach on Beyond Born-Oppenheimer Based Ab Initio Constructed Diabatic Potential Energy Surfaces
Ghosh S, Sahoo T, Baer M, Adhikari S |
| 746 - 753 |
Electron Affinity and Electronic Structure of Hexafluoroacetone (HFA) Revealed by Photodetaching the [HFA](center dot)(-) Radical Anion
Wang L, Hang J, Yuan QQ, Cao WJ, Zhou XG, Liu SL, Wang XB |
| 754 - 769 |
Transferred-Rotational-Echo Double Resonance
Zhang XZC, Forster MC, Nimerovsky E, Movellan KT, Andreas LB |
| 770 - 776 |
Tracing the Coherent Manipulation of Rotational Dynamics by Shaped Femtosecond Pulse-Induced Two-Dimensional Rotational Coherent Spectrum
Lian ZZ, Qi HX, Li J, Bo JQ, Deng JN, Liu XY, Luo SZ, Li SY, Fei DH, Chen Z, Hu Z |
| 777 - 794 |
Effect of Polymerization on the Charge-Transfer Mechanism in the One (Two)-Photon Absorption Process of D-A-Type Triphenylamine Derivatives
Wei J, Li YZ, Song P, Yang YH, Ma FC |
| 795 - 800 |
Uncertainty of High Temperature Heat Capacities: The Case Study of the NH Radical
Buchowiecki M |
| 801 - 815 |
1,3-Dipolar Cycloadditions by a Unified Perspective Based on Conceptual and Thermodynamics Models of Chemical Reactivity
Barrales-Martinez C, Martinez-Araya JI, Jaque P |
| 816 - 824 |
A Magnetic Superatomic Dimer with an Intense Internal Electric Dipole Moment
Bista D, Sengupta T, Reber AC, Khanna SN |
| 825 - 834 |
Charge Transfer and Spin Dynamics in a Zinc Porphyrin Donor Covalently Linked to One or Two Naphthalenediimide Acceptors
Bancroft L, Zhang JY, Harvey SM, Krzyaniak MD, Zhang P, Schaller RD, Beratan DN, Young RM, Wasielewski MR |
| 835 - 842 |
Hydride Affinities for Main-Group Hydride Reductants: Assessment of Density Functionals and Trends in Reactivities
Chan B, Luo Y, Kimura M |
| 843 - 847 |
Elusive Magnetic Compounds Originated from Planar Tetracoordinate Silicon, a Theoretical Prediction
Zhang CJ, Tian ZQ, Jia WH |
| 848 - 856 |
Dissociative Photoionization of Methyl Vinyl Ketone-Thermochemical Anchors and a Drifting Methyl Group
Weidner P, Ray AW, Bodi A, Sztaray B |
| 857 - 866 |
Photoelectron Spectra of Gd2O2- and Nonmonotonic Photon- Energy-Dependent Variations in Populations of Close-Lying Neutral States
Mason JL, Harb H, Abou Taka A, McMahon AJ, Huizenga CD, Corzo H, Hratchian HP, Jarrold CC |
| 867 - 874 |
Organic Mixed-Valence Compounds and the Overhauser Effect in Insulating Solids
Pylaeva S, Marx P, Singh G, Kuhne TD, Roemelt M, Elgabarty H |
| 875 - 884 |
Theoretical Engineering of Singlet Fission Kinetics in Perylene Bisimide Dimer with Chromophore Rotation
Hong Y, Kim J, Kim D, Kim H |
| 885 - 894 |
Vibrational Radiationless Transition from Triplet States of Chromophores at Room Temperature
Hirata S, Bhattacharjee I |
