| Multiple-spin coherence transfer in linear Ising spin chains and beyond: Numerically optimized pulses and experiments M Nimbalkar, R Zeier, JL Neves, SB Elavarasi, H Yuan, N Khaneja, ... Physical Review A—Atomic, Molecular, and Optical Physics 85 (1), 012325, 2012 | 28 | 2012 |
| Structural, electronic, magnetic and half-metallic properties of cubic perovskites NaBeO3 and KBeO3 using PBE-GGA and TB-mBJ approach: A DFT perspective V Ashwin, MB Ahamed, SB Elavarasi Applied Physics A 126 (11), 880, 2020 | 22 | 2020 |
| Effect of fluorination on bandgap, first and second order hyperpolarizabilities in lithium substituted adamantane: A time dependent density functional theory SB Elavarasi, D Mariam, MU Momeen, J Hu, M Guin Chemical Physics Letters 715, 310-316, 2019 | 16 | 2019 |
| Characterization of the 19F chemical shielding tensor using cross-correlated spin relaxation measurements and quantum chemical calculations SB Elavarasi, K Dorai Chemical Physics Letters 489 (4-6), 248-253, 2010 | 15 | 2010 |
| DFT calculations, Hirshfeld surface analysis and docking studies of 3-anisaldehyde thiosemicarbazone M Guin, S Khanna, SB Elavarasi, P Sarkar Journal of Chemical Sciences 132, 81, 2020 | 11 | 2020 |
| A DFT+ U study to report magnetic phase transition, electronic properties and half metallic ferromagnetism in palladium oxide using Hubbard method MMS Sirajuddeen, M Sundareswari, IR Mohamed, SB Elavarasi, IN Lone, ... Materials Chemistry and Physics 241, 122263, 2020 | 11 | 2020 |
| Using the chemical shift anisotropy tensor of carbonyl backbone nuclei as a probe of secondary structure in proteins SB Elavarasi, A Kumari, K Dorai The Journal of Physical Chemistry A 114 (18), 5830-5837, 2010 | 11 | 2010 |
| Theoretical investigation of triphenylamine/anthradithiophene based systems as potential organic hole transport materials for perovskite solar cells R Singh, SB Elavarasi, M Guin Chemical Physics Letters 836, 141057, 2024 | 6 | 2024 |
| Mapping NMR chemical shift anisotropy parameters of backbone nuclei onto secondary structure elements in proteins SB Elavarasi, K Dorai Journal of Biomolecular Structure and Dynamics 27 (4), 561-572, 2010 | 6 | 2010 |
| Hydrogen bonded complexes of rhodanine with H2X/CH3XH (X= O, S, Se) M Guin, K Rautela, RA Roopa, CS Shantharam, SB Elavarasi Computational and Theoretical Chemistry 1196, 113134, 2021 | 5 | 2021 |
| A dft investigation of the dependence of c13 and f19 csa parameters on diameter and surface decorated functional groups in f-swcnts S Divya, A Kumari, SB Elavarasi Materials Chemistry and Physics 223, 715-722, 2019 | 3 | 2019 |
| NMR, magnetic and electronic investigations of fluorinated nanotubes with different coverage of fluorine SB Elavarasi, S Divya, MV Priya, MS Sirajuddeen Chemical Physics Letters 742, 137142, 2020 | 2 | 2020 |
| Density functional theory investigation of triazole substituted nitro borazine derivatives as high energy density material M Guin, JB Singh, A Sharma, SB Elavarasi Materials Today: Proceedings 72, 120-125, 2023 | 1 | 2023 |
| Effect of hydrostatic pressure and the emergence of half metallic ferromagnetism in rhodium oxide-A DFT+ U perspective MMS Sirajuddeen, M Sundareswari, IR Mohamed, SB Elavarasi, ... Computational Condensed Matter 21, e00425, 2019 | 1 | 2019 |
| Exploring the impact of tailored π-linkers on perovskite solar cell efficiency: a computational study in triphenylamine-based hole transport material design R Singh, K Sharma, SB Elavarasi, M Guin Optical and Quantum Electronics 56 (6), 1002, 2024 | | 2024 |
| Computational Condensed Matter M Sundareswari, MMS Sirajuddeen, IR Mohamed, SB Elavarasi, ... | | 2019 |
| Computational Condensed Matter MMS Sirajuddeen, M Sundareswari, IR Mohamed, SB Elavarasi, ... | | 2019 |
| Investigations of NMR Chemical Shift Anisotropy as a Structural Probe in Biomolecules using Spin Relaxation Experiments and Quantum Chemical Computations SB ELAVARASI INDIAN INSTITUTE OF TECHNOLOGY MADRAS, 2010 | | 2010 |
