화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Structure-Photochemical Function Relationships in the Photobasicity of Aromatic Heterocycles Containing Multiple Ring Nitrogen Atoms
Alamudun SF, Tanovitz K, Espinosa L, Fajardo A, Galvan J, Petit AS
Journal of Physical Chemistry A, 125(1), 13, 2021
2 Structure-Photochemical Function Relationships in Nitrogen-Containing Heterocyclic Aromatic Photobases Derived from Quinoline
Alamudun SF, Tanovitz K, Fajardo A, Johnson K, Pham A, Araghi TJ, Petit AS
Journal of Physical Chemistry A, 124(13), 2537, 2020
3 Nonstatistical Dissociation Dynamics of Nitroaromatic Chromophores
Blackshaw KJ, Ortega BI, Quartey NK, Fritzeen WE, Korb RT, Ajmani AK, Montgomery L, Marracci M, Vanegas GG, Galvan J, Sarvas Z, Petit AS, Kidwell NM
Journal of Physical Chemistry A, 123(19), 4262, 2019
4 Simple and Efficient Theoretical Approach To Compute 2D Optical Spectra
Jain A, Petit AS, Anna JM, Subotnik JE
Journal of Physical Chemistry B, 123(7), 1602, 2019
5 Electronic Structure and Formation of Simple Ferryloxo Complexes: Mechanism of the Fenton Reaction
Petit AS, Pennifold RCR, Harvey JN
Inorganic Chemistry, 53(13), 6473, 2014
6 Simultaneous Evaluation of Multiple Rotationally Excited States of H-3(+), H3O+, and CH5+ Using Diffusion Monte Carlo
Petit AS, Ford JE, McCoy AB
Journal of Physical Chemistry A, 118(35), 7206, 2014
7 Infrared-driven unimolecular reaction of CH3CHOO Criegee intermediates to OH radical products
Liu F, Beames JM, Petit AS, McCoy AB, Lester MI
Science, 345(6204), 1596, 2014
8 Diffusion Monte Carlo Approaches for Evaluating Rotationally Excited states of Symmetric Top Molecules: Application to H3O+ and D3O+ (vol 113, pg 12706, 2009)
Petit AS, McCoy AB
Journal of Physical Chemistry A, 115(33), 9325, 2011
9 Ruthenium Agostic (Phosphinoaryl)borane Complexes: Multinuclear Solid-State and Solution NMR, X-ray, and DFT Studies
Gloaguen Y, Alcaraz G, Petit AS, Clot E, Coppel Y, Vendier L, Sabo-Etienne S
Journal of the American Chemical Society, 133(43), 17232, 2011
10 Diffusion Monte Carlo Approaches for Evaluating Rotationally Excited States of Symmetric Top Molecules: Application to H3O+ and D3O+
Petit AS, Mccoy AB
Journal of Physical Chemistry A, 113(45), 12706, 2009