Mahesh Hariharan

ORCID: 0000-0002-3237-6235
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About
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Research Areas
  • Crystallization and Solubility Studies
  • X-ray Diffraction in Crystallography
  • Crystallography and molecular interactions
  • Luminescence and Fluorescent Materials
  • Photochemistry and Electron Transfer Studies
  • DNA and Nucleic Acid Chemistry
  • Organic Electronics and Photovoltaics
  • Advanced biosensing and bioanalysis techniques
  • Synthesis and Properties of Aromatic Compounds
  • Perovskite Materials and Applications
  • Photochromic and Fluorescence Chemistry
  • Molecular Junctions and Nanostructures
  • Spectroscopy and Quantum Chemical Studies
  • Photoreceptor and optogenetics research
  • Porphyrin and Phthalocyanine Chemistry
  • Molecular Sensors and Ion Detection
  • Musicology and Musical Analysis
  • Conducting polymers and applications
  • Organic Light-Emitting Diodes Research
  • Advancements in Battery Materials
  • Organic and Molecular Conductors Research
  • Heusler alloys: electronic and magnetic properties
  • Molecular spectroscopy and chirality
  • Fullerene Chemistry and Applications
  • Diverse Musicological Studies

Indian Institute of Science Education and Research Thiruvananthapuram
2016-2025

Vellore Institute of Technology University
2023-2024

University of Notre Dame
2022

Northwestern University
2008-2013

National Institute for Interdisciplinary Science and Technology
2006-2010

Weizmann Institute of Science
2010

Indian Institute of Science Education and Research Berhampur
2010

Indian Institute of Science Education and Research, Tirupati
2010

Indian Institute of Science Education and Research Mohali
2010

Argonne National Laboratory
2009

Organic materials for Li-ion battery application continue gaining attention due the virtue of low cost, environmental benignity, and so on. A new class electroactive organic material called polyimides is particularly important to extra stability exhibited at higher current rates. High-performance rechargeable lithium cathodes based on 3,4,9,10-perylenetetracarboxylicacid-dianhydride are prepared. The novel electrodes exhibit good rate capability improved cycling stability, which result from...

10.1021/jz4017359 article EN The Journal of Physical Chemistry Letters 2013-09-09

Core-twisted aromatics exhibit enhanced intersystem crossing upon photoexcitation when compared to their planar analogs.

10.1039/c6sc05126j article EN cc-by-nc Chemical Science 2016-12-20

With the objective of developing small molecule based probes for proteins, interactions polyhydroxyl-substituted squaraine dye (SQ) with bovine serum albumin (BSA) have been investigated by absorption, steady-state and time-resolved fluorescence, circular dichroism (CD), cyclic voltammetry (CV), 1H NMR, scanning electron, tapping mode atomic force microscopic techniques. Increase in addition BSA resulted increase absorbance fluorescence quantum yields (80-fold) SQ, along significant...

10.1021/ja061301x article EN Journal of the American Chemical Society 2006-04-19

With the objective of developing small molecule based receptors for nucleosides and nucleotides, interactions a cyclic donor-acceptor conjugate 1 with adenosine, AMP, ADP, CTP, UTP, ITP, ATP, GTP have been investigated by absorption, steady-state, time-resolved fluorescence, voltammetry (CV), NMR, fluorescence indicator displacement techniques. Titration fluorescent indicator, 8-hydroxy-1,3,6-pyrene trisulfonate (HPTS), resulted in nearly complete quenching HPTS, along 25% hypochromicity its...

10.1021/ja062651m article EN Journal of the American Chemical Society 2006-08-12

<italic>N</italic>,<italic>N</italic>′-diamino-3,4,9,10-perylenetetracarboxylic polyimide (PI) based materials show excellent electrochemical performance as cathodes for sodium-ion batteries and an all-organic sodium ion battery using this the cathode disodium terephthalate (NaTP) (pre-sodiated) anode is demonstrated.

10.1039/c5ta02043c article EN Journal of Materials Chemistry A 2015-01-01

We report the effect of steric factors a few squaraine dyes, bis(2,4,6-trihydroxyphenyl)squaraine (1), bis(3,5-dibromo-2,4,6-trihydroxyphenyl)squaraine (2), and bis(3,5-diiodo-2,4,6-trihydroxyphenyl) (3), on their binding with human (HSA) bovine (BSA) serum albumins employing photophysical, chiroptical, biophysical, microscopic techniques. These dyes interact very efficiently exhibit site selectivity, involving synergistic effects hydrophobic, hydrogen bonding, electrostatic interactions....

10.1021/jp100369x article EN The Journal of Physical Chemistry B 2010-04-12

Abstract Organic rechargeable batteries gain huge scientific interest owing to the design flexibility and resource renewability of active materials. However, low reduction potentials still remain a challenge compete with inorganic cathodes. This study demonstrates simple efficient approach tune redox properties perylene diimides (PDIs) as high voltage cathodes for organic‐based sodium‐ion (SIBs). With appropriate electron‐withdrawing groups substituents on diimides, this shows remarkable...

10.1002/aenm.201701316 article EN Advanced Energy Materials 2017-07-18

Solvent-free crystal structure of N,N-bis(propylacetyl)-1,6,7,12-tetrabromoperylene-3,4:9,10-bis(dicarboximide), PDI-Br4, obtained by X-ray diffraction reveals the core-twisted perylene motif having π–π stacks at an interplanar separation 3.7 Å. Slip-stacked arrangement PDI units in PDI-Br4 arises due to presence bulky bromine atoms. Femtosecond pump–probe measurements monomeric toluene reveal ultrafast intersystem crossing (τISC < 110 fs) when excited 400 nm. Triplet quantum yield (ΦT) 19 ±...

10.1021/acs.jpcc.6b00755 article EN The Journal of Physical Chemistry C 2016-04-07

Abstract Exciton interactions in molecular aggregates play a crucial role tailoring the optical behaviour of π‐conjugated materials. Though vital for optoelectronic applications, ideal Greek cross‐dipole ( α =90°) stacking chromophores remains elusive. We report novel cross (+) assembly 1,7‐dibromoperylene‐3,4,9,10‐tetracarboxylic tetrabutylester (PTE‐Br 2 ) which exhibits null exciton coupling mediated monomer‐like characteristics crystalline state. In contrast, nonzero X‐type =70.2°,...

10.1002/anie.201810209 article EN Angewandte Chemie International Edition 2018-10-19

A comprehensive understanding of the structure-property relationships in multichromophoric architectures has pushed limits for developing robust photosynthetic mimics and molecular photovoltaics. The elusive phenomenon null exciton splitting gathered immense attention recent years owing to occurrence unique chromophoric consequent emergent properties. Herein, we unveil hitherto unobserved coupling assisted highly efficient photoinduced symmetry-breaking charge separation (SB-CS) a Greek...

10.1021/jacs.1c05793 article EN Journal of the American Chemical Society 2021-08-09

The generation of electron–hole radical pair at the active layer organic photovoltaics through symmetry-breaking charge separation (SB-CS) has a crucial role in enhancing open-circuit voltage (Voc) and thereby increasing power conversion efficiency. Since SB-CS materials achieve intramolecular with negligible energetic driving force decelerated recombination (CR) rate, been subjected to extensive experimental theoretical studies. This Focus Review assesses fundamentals photosynthetic...

10.1021/acsenergylett.1c02412 article EN ACS Energy Letters 2022-01-26

We report a nonparallel stacked arrangement of donor–acceptor (D–A) pairs for prolonging the lifetime photoinduced charge-separated states. Hydrogen–hydrogen steric repulsion in naphthalimide-naphthalene (NIN) dyad destabilizes planar geometry between constituent units solution/ground state. Sterically imposed nonplanar allows access donor and acceptor stacks having triclinic space group crystalline Antiparallel trajectory excitons D–A can result lower probability geminate charge...

10.1021/jacs.5b08257 article EN Journal of the American Chemical Society 2015-10-06

Achieving long-lived symmetry-broken charge-separated states in chromophoric assemblies is quintessential for enhanced performance of artificial photosynthetic mimics. However, the occurrence energy trap hinders exciton and charge transport across photovoltaic devices, diminishing power conversion efficiency. Herein, we demonstrate unprecedented excimer formation relaxed excited-state geometry bichromophoric systems impeding lifetime states. Core-annulated perylenediimide dimers (SC-SPDI2...

10.1039/d2sc04387d article EN cc-by-nc Chemical Science 2022-01-01

We report the room temperature phosphorescence upon iodination on a crystalline eumelanin monomer with shielded hydroxyl moieties, ethyl 5,6-dimethoxyindole-2-carboxylate (DMICE). Ultrafast intersystem crossing (ISC) is observed in iodinated (IDMICE) as well brominated (BDMICE) analogues of derivative solution. The triplet quantum yields (φ

10.1002/chem.202400499 article EN Chemistry - A European Journal 2024-03-19

We prepared novel cholesterol-appended squaraine dye 1 and model 2 investigated their aggregation behavior in solution thin films using photophysical, chiroptical, microscopic techniques. Investigations on the dependence of solvent composition (good/poor, CHCl3/CH3CN) demonstrated that forms two H-type chiral supramolecular assemblies with opposite chirality at different good/poor compositions. Model compound formed J-type achiral under similar conditions. The assembly observed lower...

10.1002/chem.200700130 article EN Chemistry - A European Journal 2007-04-16

The self-assembly of DNA dumbbell conjugates possessing hydrophobic perylenediimide (PDI) linkers separated by an eight-base pair A-tract has been investigated. Cryo-TEM images obtained from dilute solutions the in aqueous buffer containing 100 mM NaCl show presence structures corresponding to linear end-to-end assemblies 10−30 monomers. formation this size is consistent with analysis UV−vis and fluorescence spectra these for content PDI monomer dimer chromophores. Assembly dependent upon...

10.1021/ja1076525 article EN Journal of the American Chemical Society 2010-10-18

Charge on through: Perylenediimide chromophores incorporated into DNA hairpins serve as base-pair surrogates and form a zipperlike intercalated structure (see picture). Electron hopping was observed within the chromophore stacks upon one-electron reduction. Detailed facts of importance to specialist readers are published "Supporting Information". Such documents peer-reviewed, but not copy-edited or typeset. They made available submitted by authors. Please note: The publisher is responsible...

10.1002/anie.200907339 article EN Angewandte Chemie International Edition 2010-02-28

The structure and properties of hairpin-forming bis(oligonucleotide) conjugates possessing perylenediimide (PDI) chromophores as hairpin linkers have been investigated using a combination spectroscopic computational methods. These exist predominantly monomer hairpins at room temperature in the absence added salt head-to-head dimers presence >50 mM NaCl. dimer is consistent with results small-angle X-ray scattering aqueous solution molecular dynamics simulation. nonconjugated PDI water...

10.1021/ja900347t article EN Journal of the American Chemical Society 2009-04-01

The paper presents quantum yield results for the [2+2] and 6-4 photodimerization of TT steps in several DNA structures, including hairpins where context dependence is determined, it develops a theoretical model that correctly describes trends dimerization with structure. conjugates considered include dT20, dA20dT20, three alkane-linked contain single step. modeling process based on CASSCF electronic structure calculations ethylene + ethylene, which show photoexcitation low-lying excited...

10.1021/jp100983t article EN The Journal of Physical Chemistry B 2010-03-22

Quantum theory of atoms-in-molecules and Hirshfeld surface analyses indicated an increase in the extent (i) C-H···H-C; (ii) C-H···O, (iii) π-π interactions a decrease σ-π interaction, interplanar angle between vicinal pyrene units series acetylpyrene derivatives offering blue-green-orange emissive crystals.

10.1039/c4cc01897d article EN Chemical Communications 2014-01-01
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