| The rise and fall of anomalies in tetrahedral liquids W Hujo, B Shadrack Jabes, VK Rana, C Chakravarty, V Molinero Journal of Statistical Physics 145, 293-312, 2011 | 85 | 2011 |
| Tetrahedral order, pair correlation entropy, and waterlike liquid state anomalies: Comparison of GeO2 with BeF2, SiO2, and H2O BS Jabes, M Agarwal, C Chakravarty The Journal of Chemical Physics 132 (23), 2010 | 65 | 2010 |
| Water and other tetrahedral liquids: order, anomalies and solvation BS Jabes, D Nayar, D Dhabal, V Molinero, C Chakravarty Journal of Physics: Condensed Matter 24 (28), 284116, 2012 | 62 | 2012 |
| Excess entropy scaling of transport properties in network-forming ionic melts (SiO 2 and BeF 2) M Agarwal, M Singh, B Shadrack Jabes, C Chakravarty The Journal of chemical physics 134 (1), 2011 | 47 | 2011 |
| Fluctuation-driven anisotropy in effective pair interactions between nanoparticles: Thiolated gold nanoparticles in ethane BS Jabes, HOS Yadav, SK Kumar, C Chakravarty The Journal of chemical physics 141 (15), 2014 | 30 | 2014 |
| Probing spatial locality in ionic liquids with the grand canonical adaptive resolution molecular dynamics technique BS Jabes, C Krekeler, R Klein, L Delle Site The Journal of Chemical Physics 148 (19), 193804, 2018 | 27 | 2018 |
| Extraction of Chemical Structures from Literature and Patent Documents using Open Access Chemistry Toolkits: A Case Study with PFAS SJ Barnabas, T Böhme, S Boyer, M Irmer, C Ruttkies, I Wetherbee, ... Digital Discovery; ChemRxiv. Cambridge: Cambridge Open Engage; 2022; https …, 2022 | 26 | 2022 |
| Structure and transport properties of LiF–BeF2 mixtures: Comparison of rigid and polarizable ion potentials# BS Jabes, M Agarwal, C Chakravarty Journal of Chemical Sciences 124, 261-269, 2012 | 26 | 2012 |
| Structural Locality and Early Stage of Aggregation of Micelles in Water: An Adaptive Resolution Molecular Dynamics Study (Adv. Theory Simul. 6/2018) BS Jabes, R Klein, L Delle Site Advanced Theory and Simulations 1 (6), 1870014, 2018 | 24* | 2018 |
| Relating composition, structural order, entropy and transport in multi-component molten salts BS Jabes, C Chakravarty The Journal of Chemical Physics 136 (14), 2012 | 23 | 2012 |
| Nanoscale domains in ionic liquids: A statistical mechanics definition for molecular dynamics studies B Shadrack Jabes, L Delle Site The Journal of Chemical Physics 149 (18), 2018 | 19 | 2018 |
| Relating structure, entropy, and energy of solvation of nanoscale solutes: Application to gold nanoparticle dispersions D Nayar, HOS Yadav, BS Jabes, C Chakravarty The Journal of Physical Chemistry B 116 (43), 13124-13132, 2012 | 13 | 2012 |
| Universal repulsive contribution to the solvent-induced interaction between sizable, curved hydrophobes Jabes, B. S., Bratko, D., Luzar, A. The Journal of Physical Chemistry Letters 7 (16), 3158-63, 2016 | 10 | 2016 |
| Characterizing Polymer Hydration Shell Compressibilities with the Small-System Method M Tripathy, S Bharadwaj, B Shadrack Jabes (equal contribution), ... Nanomaterials 10 (8), 1460, 2020 | 9 | 2020 |
| Curvature dependence of the effect of ionic functionalization on the attraction among nanoparticles in dispersion BS Jabes, D Bratko, A Luzar The Journal of Chemical Physics 148, 222815, 2018 | 9 | 2018 |
| Metastable vapor in a janus nanoconfinement BS Jabes, J Driskill, D Vanzo, D Bratko, A Luzar The Journal of Physical Chemistry C 121 (24), 13144-13150, 2017 | 6 | 2017 |
| Tetrahedral order, pair correlation entropy, and waterlike liquid state anomalies: Comparison of GeO2 with BeF2, SiO2, and H2O B Shadrack Jabes, M Agarwal, C Chakravarty Journal of Chemical Physics 132 (23), 234507_1-234507_12, 2010 | 4 | 2010 |
| Ionic Liquids Treated within the Grand Canonical Adaptive Resolution Molecular Dynamics Technique BS Jabes, C Krekeler Computation 6 (1), 23, 2018 | 3 | 2018 |
| Extracting and Comparing PFAS from Literature and Patent Documents using Open Access Chemistry Toolkits S Barnabas, T Böhme, S Boyer, M Irmer, C Ruttkies, I Wetherbee, ... | 2 | 2022 |
| Direct Calculation of Entropic Components in Cohesive Interaction Free Energies S Bharadwaj, B Shadrack Jabes (equal contribution), NFA van der Vegt J. Phys. Chem. B 125 (39), 11026-11035, 2021 | 2 | 2021 |
Charusita ChakravartyProfessor of Chemistry, Indian Institute of Technology Delhi, New Delhi, IndiaVerified email at chemistry.iitd.ac.in
