Catálogo de publicaciones - revistas
The Journal of Physical Chemistry A
Resumen/Descripción – provisto por la editorial
No disponible.
Palabras clave – provistas por la editorial
No disponibles.
Disponibilidad
| Institución detectada | Período | Navegá | Descargá | Solicitá |
|---|---|---|---|---|
| No detectada | desde ene. 1997 / hasta dic. 2023 | ACS Publications |
Información
Tipo de recurso:
revistas
ISSN impreso
1089-5639
ISSN electrónico
1520-5215
Editor responsable
American Chemical Society (ACS)
País de edición
Estados Unidos
Fecha de publicación
1997-
Cobertura temática
Tabla de contenidos
doi: 10.1021/jp408319t
Structural Modeling of Dahlia-Type Single-Walled Carbon Nanohorn Aggregates by Molecular Dynamics
L. Hawelek; A. Brodka; John C. Dore; Alex C. Hannon; S. Iijima; M. Yudasaka; T. Ohba; K. Kaneko; A. Burian
Palabras clave: Physical and Theoretical Chemistry.
Pp. 9057-9061
Absorption Cross Sections of 2-Nitrophenol in the 295–400 nm Region and Photolysis of 2-Nitrophenol at 308 and 351 nm
Manuvesh Sangwan; Lei Zhu
Palabras clave: Physical and Theoretical Chemistry.
Pp. 9958-9967
On the Role of Nonspherical Cavities in Short Length-Scale Density Fluctuations in Water
Gabriele Cesare Sosso; Sebastiano Caravati; Grant Rotskoff; Suriyanarayan Vaikuntanathan; Ali Hassanali
Palabras clave: Physical and Theoretical Chemistry.
Pp. 370-380
Temperature Drift of Conformational Equilibria of Butyl Alcohols Studied by Near-Infrared Spectroscopy and Fully Anharmonic DFT
Justyna Grabska; Krzysztof B. Beć; Yukihiro Ozaki; Christian W. Huck
Palabras clave: Physical and Theoretical Chemistry.
Pp. 1950-1961
Tuning the Strength of the Resonance-Assisted Hydrogen Bond in o-Hydroxybenzaldehyde by Substitution in the Aromatic Ring1
Gerard Pareras; Marcin Palusiak; Miquel Duran; Miquel Solà; Sílvia Simon
Palabras clave: Physical and Theoretical Chemistry.
Pp. 2279-2287
Quantifying Uncertainties in Solvation Procedures for Modeling Aqueous Phase Reaction Mechanisms
Alex M. Maldonado; Satoshi Hagiwara; Tae Hoon Choi; Frank Eckert; Kathleen Schwarz; Ravishankar Sundararaman; Minoru Otani; John A. Keith
Palabras clave: Physical and Theoretical Chemistry.
Pp. 154-164
Reaction of Singlet Oxygen with the Ethylene Group: Implications for Electrolyte Stability in Li-Ion and Li-O2 Batteries
J. Wayne Mullinax; Charles W. Bauschlicher; John W. Lawson
Palabras clave: Physical and Theoretical Chemistry.
Pp. 2876-2884
Role of Charge Transfer in Halogen Bonding
Brandon Inscoe; Hemali Rathnayake; Yirong Mo
Palabras clave: Physical and Theoretical Chemistry.
Pp. 2944-2953
Effective Two-Body Interactions
Cameron Mackie; Alexander Zech; Martin Head-Gordon
Palabras clave: Physical and Theoretical Chemistry.
Pp. 7750-7758
Unusually Large Hydrogen-Bond Cooperativity in Hydrogen Fluoride Clusters, (HF)n, n = 3 to 8, Revealed by the Molecular Tailoring Approach
Deepak Patkar; Mini Bharati Ahirwar; Shridhar R. Gadre; Milind M. Deshmukh
Palabras clave: Physical and Theoretical Chemistry.
Pp. 8836-8845