| 9679 - 9681 |
Celebrating Our 120th Anniversary
Schatz GC |
| 9682 - 9689 |
Resolved (v(1), v(2)=1) Combination Vibrational States of CF3 Fragments in the Photofragment Translational Spectra of CF3I
Lin D, Hu LL, Liu S, Qi WK, Cheng M, Du YK, Zhu QH |
| 9690 - 9701 |
Threshold Collision-Induced Dissociation of Proton-Bound Hydrazine and Dimethylhydrazine Clusters
McNary CP, Armentrout PB |
| 9702 - 9706 |
Conjugation Length Distribution in Poly(p-phenylenevinylene) (PPV) Films
da Silva MC, Cassemiro SD, Machado AM, Alves JCF, Nogueira SL, Jarrosson T, Serein-Spirau F, Akcelrud L, Tozoni JR, Silva RA, Freire JA, Marletta A |
| 9707 - 9718 |
Anharmonicity in the Vibrational Spectra of Naphthalene and Naphthalene-d(8): Experiment and Theory
Chakraborty S, Banik S, Das PK |
| 9719 - 9731 |
Photophysical Properties and Electronic Structure of Porphyrins Bearing Zero to Four meso-Phenyl Substituents: New Insights into Seemingly Well Understood Tetrapyrroles
Mandal AK, Taniguchi M, Diers JR, Niedzwiedzki DM, Kirmaier C, Lindsey JS, Bocian DF, Holten D |
| 9732 - 9739 |
CH3NH3PbI3, A Potential Solar Cell Candidate: Structural and Spectroscopic Investigations
Nandi P, Giri C, Joseph B, Rath S, Manju U, Topwal D |
| 9740 - 9748 |
Calculated Resonance Vibrational Raman Optical Activity Spectra of Naproxen and Ibuprofen
Krausbeck F, Autschbach J, Reiher M |
| 9749 - 9758 |
Chemical Composition and Properties of the Liquid-Vapor Interface of Aqueous C1 to C4 Monofunctional Acid and Alcohol Solutions
Lee MT, Orlando F, Artiglia L, Chen SZ, Ammann M |
| 9759 - 9766 |
Models of Isotopic Water Diffusion in Spherical Aerosol Particles
Moridnejad A, Preston TC |
| 9767 - 9775 |
Theoretical Investigation of Molecular and Electronic Structures of Buckminsterfullerene-Silicon Quantum Dot Systems
Fedorov AS, Kuzubov AA, Kholtobina AS, Kovaleva EA, Knaup J, Irle S |
| 9776 - 9781 |
An ab Initio Study on the Structure, Energetics, and Spectra of Cl-center dot center dot center dot(CO2)(n) Clusters
Pathak AK |
| 9782 - 9793 |
Theoretical Investigation of Substituent Effects on the Dihydroazulene/Vinylheptafulvene Photoswitch: Increasing the Energy Storage Capacity
Hansen MH, Elm J, Olsen ST, Gejl AN, Storm FE, Frandsen BN, Skov AB, Nielsen MB, Kjaergaard HG, Mikkelsen KV |
| 9794 - 9804 |
Efficient Geometry Optimization of Large Molecular Systems in Solution Using the Fragment Molecular Orbital Method
Nakata H, Fedorov DG |
| 9805 - 9814 |
Substrate Sulfoxidation by an Iron(IV)-Oxo Complex: Benchmarking Computationally Calculated Barrier Heights to Experiment
Reinhard FGC, Faponle AS, de Visser SP |
| 9815 - 9828 |
Ab Initio Vibrational Spectroscopy of cis- and trans-Formic Acid from a Global Potential Energy Surface
Tew DP, Mizukami W |
| 9829 - 9840 |
Envisaging Structural Insight of a Terminally Protected Proline Dipeptide by Raman Spectroscopy and Density Functional Theory Analyses
Das S, Pal U, Chatterjee M, Pramanik SK, Banerji B, Maiti NC |
| 9841 - 9856 |
Probing Electronic Wave Functions of Sodium-Doped Clusters: Dyson Orbitals, Anisotropy Parameters, and Ionization Cross-Sections
Gunina AO, Krylov AI |
| 9857 - 9866 |
Quasi-Restricted Orbital Treatment for the Density Functional Theory Calculations of the Spin-Orbit Term of Zero-Field Splitting Tensors
Sugisaki K, Toyota K, Sato K, Shiomi D, Takui T |
| 9867 - 9877 |
Nearest-Neighbor and Non-Nearest-Neighbor Interactions between Substituents in the Benzene Ring. Experimental and Theoretical Study of Functionally Substituted Benzamides
Verevkin SP, Emel'yanenko VN, Nagrimanov RN |
| 9878 - 9885 |
Implementation of INDO/SCI with COSMO Implicit Solvation and Benchmarking for Solvatochromic Shifts
Gieseking RL, Ratner MA, Schatz GC |
| 9886 - 9886 |
Modeling the Radical Chemistry in an Oxidation Flow Reactor: Radical Formation and Recycling, Sensitivities, and the OH Exposure Estimation Equation (vol 119, pg 4418, 2015)
Li R, Palm BB, Ortega AM, Hlywiak J, Hu WW, Peng Z, Day DA, Knote C, Brune WH, de Gouw JA, Jimenez JL |
