화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.123, No.30 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (25 articles)

6381 - 6383 Tribute to Hanna Reisler
Wittig C, Sanov A, Reid S, Krylov A
6384 - 6389 Hanna Reisler: Autobiographical Notes
Reisler H
6399 - 6410 Dynamic Stark-Induced Coherent pi-Electron Rotations in a Chiral Aromatic Ring Molecule: Application to Phenylalanine
Mineo H, Kim GS, Lin SH, Fujimura Y
6411 - 6419 Comparative Photophysical Study of Differently Substituted Cinnamaldehyde-Based Chalcones: From Intramolecular Charge Transfer to Fluorogenic Solvent Selectivity
Bhattacharyya A, Makhal SC, Guchhait N
6420 - 6429 Lewis Strength Determines Specific-Ion Effects in Aqueous and Nonaqueous Solvents
Gregory KP, Webber GB, Wanless EJ, Page AJ
6430 - 6438 Formation of Copper(I) Oxide- and Copper(I) Cyanide-Polyacetonitrile Nanocomposites through Strong-Field Laser Processing of Acetonitrile Solutions of Copper(II) Acetate Dimer
Tangeysh B, Odhner JH, Wang Y, Wayland BB, Levis RJ
6439 - 6454 Theoretical Study of Barrierless Chemical Reactions Involving Nearly Elastic Rebound: The Case of S(D-1) + X-2, X = H, D
Bonnet L, Larregaray P, Lara M, Launay JM
6455 - 6462 Conical Intersections in Organic Molecules: Benchmarking Mixed-Reference Spin-Flip Time-Dependent DFT (MRSF-TD-DFT) vs Spin-Flip TD-DFT
Lee S, Shostak S, Filatov M, Choi CH
6463 - 6471 Ultrafast Excited-State Intermolecular Proton Transfer in Indigo Oligomer
He XM, Yang F, Li S, He XX, Yu AC, Chen JQ, Xu JH, Wang JP
6472 - 6481 Theoretical Prediction of Optical Absorption and Emission in Thiolated Gold Clusters
Day PN, Pachter R, Nguyen KA, Jin RC
6482 - 6490 Infrared Intensification and Hydrogen Bond Stabilization: Beyond Point Charges
Duarte LJ, Silva AF, Richter WE, Bruns RE
6491 - 6495 Link between Photoelectron Circular Dichroism and Fragmentation Channel in Strong Field Ionization
Fehre K, Eckart S, Kunitski M, Janke C, Trabert D, Rist J, Weller M, Hartung A, Schmidt LPH, Jahnke T, Dorner R, Schoffler M
6496 - 6505 Spectroscopic and Time-Dependent DFT Study of the Photophysical Properties of Substituted 1,4-Distyrylbenzenes
Estrada-Florez SE, Moncada FS, Lanterna AE, Sierra CA, Scaiano JC
6506 - 6526 Hydrogen-Bonding Motifs and Proton-Transfer Dynamics in Electronically Excited 6-Hydroxy-2-formylfulvene
Vealey ZN, Foguel L, Vaccaro PH
6527 - 6535 CO2 Reduction on an Iron-Porphyrin Center: A Computational Study
Davethu PA, de Visser SP
6536 - 6546 Free Energies of Hydration for Metal Ions from Heats of Vaporization
Kepp KP
6547 - 6563 Nuclear Motion in the Intramolecular Dihydrogen-Bound Regime of an Aminoborane Complex
Reese DL, Steele RP
6564 - 6571 Hierarchical Basis Sets for the Calculation of Nuclear Magnetic Resonance Spin-Spin Coupling Constants Involving Either Selenium or Tellurium Nuclei
Rusakov YY, Rusakova IL
6572 - 6577 Chemical Bond Mechanism for Helium Revealed by Electronic Excitation
Cesario D, Nunzi F, Belpassi L, Pirani F, Ronca E, Tarantelli F
6578 - 6586 Globally Accurate Full-Dimensional Potential Energy Surface for H-2 + HCl Inelastic Scattering
Yao Q, Morita M, Xie CJ, Balakrishnan N, Guo H
6587 - 6595 Molecular Dynamics Simulation of Zinc Ion in Water with an ab Initio Based Neural Network Potential
Xu MY, Zhu T, Zhang JZH
6596 - 6604 Intersystem Crossings Drive Atmospheric Gas-Phase Dimer Formation
Valiev RR, Hasan G, Salo VT, Kubecka J, Kurten T
6605 - 6617 Simulated Electronic Absorption Spectra of Sulfur-Containing Molecules Present in Earth's Atmosphere
Farahani S, Frandsen BN, Kjaergaard HG, Lane JR
6618 - 6627 Theoretical Studies of Two Key Low-Lying Carbenes of C5H2 Missing in the Laboratory
Thimmakondu VS, Ulusoy I, Wilson AK, Karton A
6628 - 6634 An Easy-to-Use Tool for Modeling the Dynamics of Capacitive Deionization
Nordstrand J, Laxman K, Myint MTZ, Dutta J