Correlation and prediction of redox potentials of hydrogen evolution mononuclear cobalt catalysts via molecular electrostatic potential: a DFT study BA Anjali, FB Sayyed, CH Suresh The Journal of Physical Chemistry A 120 (7), 1112-1119, 2016 | 56 | 2016 |
Defect-engineered MOF-801 for cycloaddition of CO 2 with epoxides Y Gu, BA Anjali, S Yoon, Y Choe, YG Chung, DW Park Journal of Materials Chemistry A 10 (18), 10051-10061, 2022 | 53 | 2022 |
Microplasma band structure engineering in graphene quantum dots for sensitive and wide-range pH sensing D Kurniawan, BA Anjali, O Setiawan, KK Ostrikov, YG Chung, WH Chiang ACS Applied Materials & Interfaces 14 (1), 1670-1683, 2021 | 40 | 2021 |
Interpreting Oxidative Addition of Ph–X (X = CH3, F, Cl, and Br) to Monoligated Pd(0) Catalysts Using Molecular Electrostatic Potential BA Anjali, CH Suresh ACS omega 2 (8), 4196-4206, 2017 | 33 | 2017 |
Electronic effect of ligands vs. reduction potentials of Fischer carbene complexes of chromium: a molecular electrostatic potential analysis BA Anjali, CH Suresh New Journal of Chemistry 42 (22), 18217-18224, 2018 | 25 | 2018 |
Hydrogen-Bond-Assisted Adsorption of Nitric Oxide on Various Metal-Loaded ZSM-5 Zeolites TM Ismail, KP Prasanthkumar, C Ebenezer, BA Anjali, RV Solomon, ... Langmuir 38 (34), 10492-10502, 2022 | 7 | 2022 |
Absorption and emission properties of 5‐phenyl tris (8‐hydroxyquinolinato) M (III) complexes (M= Al, Ga, In) and correlations with molecular electrostatic potential BA Anjali, CH Suresh Journal of Computational Chemistry 41 (16), 1497-1508, 2020 | 6 | 2020 |
Predicting reduction potentials of 1, 3, 6‐triphenyl fulvenes using molecular electrostatic potential analysis of substituent effects BA Anjali, CH Suresh Journal of Computational Chemistry 39 (15), 881-888, 2018 | 6 | 2018 |
Chiral Covalent Organic Cages: Structural Isomerism and Enantioselective Catalysis K Wang, X Tang, BA Anjali, J Dong, J Jiang, Y Liu, Y Cui Journal of the American Chemical Society 146 (10), 6638-6651, 2024 | 5 | 2024 |
Blue emitting V-shaped acceptor-donor–acceptor novel ionic organic small molecule for non-doped light-emitting electrochemical cells A Puthanveedu, S Kanagaraj, AA Bai, SC Damodharan, Y Choe Organic Electronics 122, 106881, 2023 | 2 | 2023 |
Computational design of metal hydrides on a defective metal–organic framework HKUST-1 for ethylene dimerization K Hashem, R Krishnan, K Yang, BA Anjali, Y Zhang, J Jiang Physical Chemistry Chemical Physics 26 (8), 7109-7123, 2024 | 1 | 2024 |
Predicting Activation Barrier, Reduction Potential and Fluorescence Using Molecular Electrostatic Potential: Organic and Organometallic Systems B Anjali Chemical Sciences and Technology Division, National Institute for …, 2019 | | 2019 |