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acs.jpcb.9b08463.pdf.jpg18-Sep-2019Arresting an Unusual Amide Tautomer Using Divalent CationsBagchi, Sayan; Kashid, Somnath; Singh, Reman; Kwon, Hyejin; Kim, Yung Sam; Mukherjee, Arnab; Bagchi, Sayan
acs.jpcb.1c08613.pdf.jpg27-Dec-2021Association–Dissociation Dynamics of Ionic Electrolytes in Low Dielectric MediumBagchi, Sayan; Ghosh, Deborin; Sakpal, Sushil; Chatterjee, Srijan; Deshmukh, Samadhan; Kwon, Hyejin; Kim, Yung Sam; Bagchi, Sayan
2021_RSC_Advances_Porphorine.pdf.jpg2-Jan-2023Copolymers of bipyridinium and metal (Zn & Ni) porphyrin derivatives; theoretical insights and electrochemical activity towards CO2Kochreka, Sachin; Kalekar, Ajit; Mehta, Shweta; Damlin, Pia; Salomaki, Mikko; Granroth, Sari; Meltola, Niko; Joshi, Kavita; Kvarnstrom, Carita
acs.jpcb.6b02732.pdf.jpg26-Apr-2016Correlating Nitrile IR Frequencies to Local Electrostatics Quantifies Noncovalent Interactions of Peptides and ProteinsBagchi, Sayan; Deb, Pranab; Haldar, Tapas; Kashid, Somnath; Banerjee, Subhrashis; Chakrabarty, Suman; Bagchi, Sayan
JChemPhys_138_014303.pdf.jpg2-Jan-2023Correlation between the variation in observed melting temperatures and structural motifs of the global minima of gallium clusters: an ab initio studySusan, Anju; Kibey, Aniruddha; Kaware, Vaibhav; Joshi, Kavita
acs.jpcb.5b08643.pdf.jpg24-Nov-2015Cosolvent Effects on Solute–Solvent Hydrogen-Bond Dynamics: Ultrafast 2D IR InvestigationsBagchi, Sayan; Kashid, Somnath; Jin, Geun Young; Bagchi, Sayan; Kim, Yung Sam
acs.jpcb.0c10824.pdf.jpg17-Mar-2021The Curious Case of Aqueous Warfarin: Structural Isomers or Distinct Excited States?Bagchi, Sayan; Sakpal, Sushil; Ghosh, Deborin; Manae, Meghna; Hazra, Anirban; Bagchi, Sayan
acs.jpcb.2c06521.pdf.jpg6-Oct-2022Does Viscosity Drive the Dynamics in an Alcohol-Based Deep Eutectic Solvent?Bagchi, Sayan; Chatterjee, Srijan; Deshmukh, Samadhan; Bagchi, Sayan
acs.jpclett.6b01052.pdf.jpg1-Jun-2016Electrostatic Interactions Are Key to C═O n-π* Shifts: An Experimental ProofBagchi, Sayan; Haldar, Tapas; Bagchi, Sayan
acs.jpcb.9b11352.pdf.jpg10-Apr-2020Electrostatic Manifestation of Micro-Heterogeneous Solvation Structures in Deep-Eutectic Solvents: A Spectroscopic ApproachChatterjee, Srijan; Haldar, Tapas; Ghosh, Deborin; Bagchi, Sayan
acs.orglett.1c00834.pdf.jpg11-May-2021Evidence of an nN(amide) → π*Ar Interaction in N-Alkyl-N,N′-diacylhydrazinesBagchi, Sayan; Rai Deka, Jugal Kishore; Sahariah, Biswajit; Sakpal, Sushil; Bar, Arun Kumar; Bagchi, Sayan; Sarma, Bani Kanta
2020_Co3O4_NSCS.pdf.jpg2-Jan-2023Experimental and theoretical investigations of the effect of heteroatom-doped carbon microsphere supports on the stability and storage capacity of nano-Co3O4 conversion anodes for application in lithium-ion batteriesDwivedi, Pravin K.; Nair, Aathira; Mehare, Rupali S.; Chaturvedi, Vikash; Joshi, Kavita; Shelke, Manjusha V.
2014_JPCL_Experimental-determination-electrostatic-nature-carbonyl-IR-NMR_Bagchi.pdf.jpg18-Sep-2014Experimental Determination of the Electrostatic Nature of Carbonyl Hydrogen-Bonding Interactions Using IR-NMR CorrelationsBagchi, Sayan; Kashid, Somnath; Bagchi, Sayan
2022_From molecular adsorption to decomposition of methanol on various ZnO facets- A periodic DFT study.pdf.jpg2-Jan-2023From molecular adsorption to decomposition of methanol on various ZnO facets: a periodic DFT studyMehta, Shweta; Joshi, Kavita
Highly diverged novel subunit composition of apicomplexan F-type ATP synthase identified fromToxoplasma gondii.pdf.jpg13-Jul-2018Highly diverged novel subunit composition of apicomplexan F-type ATP synthase identified from Toxoplasma gondiiShanmugam, D.; Salunke, R.; Mourier, Tobias; Banerjee, Manidipa; Pain, Arnab; Shanmugam, Dhanasekaran
acs.jpcb.9b08954.pdf.jpg14-Oct-2019Hydrocarbon Chain-Length Dependence of Solvation Dynamics in Alcohol-Based Deep Eutectic Solvents: A Two-Dimensional Infrared Spectroscopic InvestigationBagchi, Sayan; Chatterjee, Srijan; Ghosh, Deborin; Haldar, Tapas; Deb, Pranab; Sakpal, Sushil; Deshmukh, Samadhan; Kashid, Somnath; Bagchi, Sayan
2023_CPI_Impact-water-fluctuation-dynamics-viscous-solvents-2DIR-study_Bagchi.pdf.jpg5-Oct-2023Impact of water addition on fluctuation dynamics in viscous solvents with varied heterogeneity: A 2D IR spectroscopic studyBagchi, Sayan; Chowdhury, Tubai; Ghosh, Sucheta; Pathania, Akhil; Kore, Shivshankar; Mon, Akhil B; Chatterjee, Srijan; Deshmukh, Samadhan
acs.jpclett.8b02398.pdf.jpg27-Aug-2018Interconverting Hydrogen-Bonding and Weak n → π* Interactions in Aqueous Solution: A Direct Spectroscopic EvidenceBagchi, Sayan; Deb, Pranab; Geun, Young Jin; Singh, Santosh; Moon, Juran; Kwon, Hyejin; Das, Aloke; Bagchi, Sayan; Kim, Yung Sam
acs.jpclett.2c00493.pdf.jpg30-Mar-2022Ligand Dynamics Time Scales Identify the Surface–Ligand Interactions in Thiocyanate-Capped Cadmium Sulfide NanocrystalsBagchi, Sayan; Deshmukh, Samadhan; Chatterjee, Srijan; Ghosh, Deborin; Bagchi, Sayan
2022_CH4.pdf.jpg2-Jan-2023Lowering the C–H bond activation barrier of methane by means of SAC@Cu(111): periodic DFT investigationsBhati, Meema; Dhumala, Jignesh; Joshi, Kavita