| 10441 - 10450 |
Photoisomerization Reaction Mechanisms of o-Nitrophenol Revealed by Analyzing Intersystem Crossing Network at the MRCI Level
Xu C, Yu L, Zhu CY, Yu JG |
| 10451 - 10461 |
The Predictive Power of the Annellation Theory: The Case of the C26H16 Cata-Condensed Benzenoid Polycyclic Aromatic Hydrocarbons
Ona-Ruales JO, Ruiz-Morales Y |
| 10462 - 10474 |
Experimental and Calculated Spectra of pi-Stacked Mild Charge-Transfer Complexes: Jet-Cooled Perylene center dot(Tetrachloroethene)(n), n=1,2
Balmer FA, Ottiger P, Leutwyler S |
| 10475 - 10480 |
A Study of the Monohydrate and Dihydrate Complexes of Perfluoropropionic Acid Using Chirped-Pulse Fourier Transform Microwave (CP-FTMW) Spectroscopy
Grubbs GS, Obenchain DA, Frank DS, Novick SE, Cooke SA, Serrato A, Lin W |
| 10481 - 10493 |
Contrasting Solid-State Fluorescence of Diynes with Small and Large Aryl Substituents: Crystal Packing Dependence and Stimuli-Responsive Fluorescence Switching
Pati AK, Gharpure SJ, Mishra AK |
| 10494 - 10501 |
Franck-Condon-like Progressions in Infrared Spectra of Biological Molecules
Zabuga AV, Kamrath MZ, Rizzo TR |
| 10502 - 10510 |
Quality Structures, Vibrational Frequencies, and Thermochemistry of the Products of Reaction of BrHg center dot with NO2, HO2, ClO, BrO, and IO
Jiao YG, Dibble TS |
| 10511 - 10526 |
A Database of Formation Enthalpies of Nitrogen Species by Compound Methods (CBS-QB3, CBS-APNO, G3, G4)
Simmie JM |
| 10527 - 10539 |
Quantum Chemical Study of the Thermochemical Properties of Organophosphorous Compounds
Khalfa A, Ferrari M, Fournet R, Sirjean B, Verdier L, Glaude PA |
| 10540 - 10552 |
Atmospheric Chemistry of (CF3)(2)CHOCH3, (CF3)(2)CHOCHO, and CF3C(O)OCH3
Osterstrom FF, Wallington TJ, Andersen MPS, Nielsen OJ |
| 10553 - 10562 |
Ab Initio Unimolecular Reaction Kinetics of CH2C(=O)OCH3 and CH3C(=O)OCH2 Radicals
Tan T, Yang XL, Ju YG, Carter EA |
| 10563 - 10574 |
The Degree of Ergodicity of ortho- and para-Aminobenzonitrile in an Electric Field
Pittman SM, Heller EJ |
| 10575 - 10581 |
Excited State Studies of Polyacenes Using the All-Order Constricted Variational Density Functional Theory with Orbital Relaxation
Senn F, Krykunov M |
| 10582 - 10588 |
Superionic Phases of the 1:1 Water-Ammonia Mixture
Bethkenhagen M, Cebulla D, Redmer R, Hamel S |
| 10589 - 10601 |
Determination of the Absolute Configurations Using Exciton Chirality Method for Vibrational Circular Dichroism: Right Answers for the Wrong Reasons?
Covington CL, Nicu VP, Polayarapu PL |
| 10602 - 10612 |
Dimethyl Sulfide-Dimethyl Ether and Ethylene Oxide-Ethylene Sulfide Complexes Investigated by Fourier Transform Microwave Spectroscopy and Ab Initio Calculation
Kawashima Y, Tatamitani Y, Mase T, Hirota E |
| 10613 - 10619 |
Designing a "Flatter" ExBox(4+) Analogue
Bachrach SM, Nickle ZOM |
| 10620 - 10627 |
Interplay between Open-Shell Character, Aromaticity, and Second Hyperpolarizabilities in Indenofluorenes
Fukuda K, Nagami T, Fujiyoshi JY, Nakano M |
| 10628 - 10628 |
Exploring the Utility of Many-Body Expansions: A Consistent Set of Accurate Potentials for the Lowest Quartet and Doublet States of the Azide Radical with Revisited Dynamics (vol 118, pg 10127, 2014)
Varandas AJC, Galvao BRL |
