화학공학소재연구정보센터
검색결과 : 84건
No. Article
1 Zero-Overlap Fluorophores for Fluorescent Studies at Any Concentration
Dhara A, Sadhukhan T, Sheetz EG, Olsson AH, Raghavachari K, Flood AH
Journal of the American Chemical Society, 142(28), 12167, 2020
2 Eliminating Systematic Errors in DFT via Connectivity-Based Hierarchy: Accurate Bond Dissociation Energies of Biodiesel Methyl Esters
Debnath S, Sengupta A, Raghavachari K
Journal of Physical Chemistry A, 123(16), 3543, 2019
3 Mo Insertion into the H-2 Bond in MoxSy- + H-2 Reactions
Gupta AK, Topolski JE, Nickson KA, Jarrold CC, Raghavachari K
Journal of Physical Chemistry A, 123(33), 7261, 2019
4 Untangling Hydrogen Bond Networks with Ion Mobility Spectrometry and Quantum Chemical Calculations: A Case Study on H(+)XPGG
Beckett D, El-Baba TJ, Gilbert K, Clemmer DE, Raghavachari K
Journal of Physical Chemistry B, 123(27), 5730, 2019
5 Redox "Innocence" of Re(I) in Electrochemical CO2 Reduction Catalyzed by Nanographene-Re Complexes
Schaugaard RN, Raghavachari K, Li LS
Inorganic Chemistry, 57(17), 10548, 2018
6 Mechanistic Role of Two-State Reactivity in a Molecular MoS2 Edge-Site Analogue for Hydrogen Evolution Electrocatalysis
Schaugaard R, Jarrold CC, Raghavachari K
Inorganic Chemistry, 57(15), 9167, 2018
7 Molybdenum Oxide Cluster Anion Reactions with C2H4 and H2O: Cooperativity and Chemifragmentation
Ray M, Schaugaard RN, Topolski JE, Kafader JO, Raghavachari K, Jarrold CC
Journal of Physical Chemistry A, 122(1), 41, 2018
8 Accurate Thermochemistry for Organic Cations via Error Cancellation using Connectivity-Based Hierarchy
Collins EM, Sengupta A, AbuSalim DI, Raghavachari K
Journal of Physical Chemistry A, 122(6), 1807, 2018
9 Allosteric Control of Photofoldamers for Selecting between Anion Regulation and Double-to-Single Helix Switching
Parks FC, Liu Y, Debnath S, Stutsman SR, Raghavachari K, Flood AH
Journal of the American Chemical Society, 140(50), 17711, 2018
10 Bond Activation and Hydrogen Evolution from Water through Reactions with M3S4 (M = Mo, W) and W3S3 Anionic Clusters
Kumar CA, Saha A, Raghavachari K
Journal of Physical Chemistry A, 121(8), 1761, 2017