Abhishek Aggarwal

ORCID: 0000-0002-3342-6484
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About
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Research Areas
  • Advanced biosensing and bioanalysis techniques
  • DNA and Nucleic Acid Chemistry
  • Advancements in Battery Materials
  • Advanced Battery Technologies Research
  • RNA and protein synthesis mechanisms
  • Molecular Junctions and Nanostructures
  • Advanced Battery Materials and Technologies
  • Fuel Cells and Related Materials
  • Machine Learning in Materials Science
  • Protein Structure and Dynamics
  • Infrared Target Detection Methodologies
  • Melanoma and MAPK Pathways
  • IoT and Edge/Fog Computing
  • CO2 Reduction Techniques and Catalysts
  • Conducting polymers and applications
  • Electrochemical Analysis and Applications
  • Analytical Chemistry and Sensors
  • Ionic liquids properties and applications
  • SARS-CoV-2 and COVID-19 Research
  • Cloud Computing and Resource Management
  • Electrocatalysts for Energy Conversion
  • Carbon dioxide utilization in catalysis
  • Advanced Aircraft Design and Technologies
  • Covalent Organic Framework Applications
  • Molecular Biology Techniques and Applications

Massachusetts Institute of Technology
2023-2025

University of California, Los Angeles
2025

Indian Institute of Science Bangalore
2018-2023

Delhi Technological University
2015-2021

Tata Consultancy Services (India)
2020

Kurukshetra University
2017

National Institute of Technology Kurukshetra
2015

Université de Montréal
2013

Motilal Nehru National Institute of Technology
2010

Bharati Vidyapeeth Deemed University
2008

In this paper we present the techniques used for University of Montréal's team submissions to 2013 Emotion Recognition in Wild Challenge. The challenge is classify emotions expressed by primary human subject short video clips extracted from feature length movies. This involves analysis acted scenes lasting approximately one-two seconds, including audio track which may contain voices as well background music. Our approach combines multiple deep neural networks different data modalities,...

10.1145/2522848.2531745 article EN 2013-11-27

As demands on Li-ion battery performance increase, the need for electrolytes with high ionic conductivity and a Li+ transference number (tLi) becomes crucial to boost power density. Unfortunately, tLi in liquid is typically <0.5 due migrating via vehicular mechanism, whereby diffuses along its solvation shell, making diffusivity slower than counteranion. Designing where ion independently of shell significant interest enhance number. In this work, we elucidate how properties solvent influence...

10.1021/acs.jpcb.3c07999 article EN The Journal of Physical Chemistry B 2024-03-29

Enhancing the power of lithium-ion batteries necessitates understanding molecular processes governing Li+ ion transfer across electrode-electrolyte interface. Here, employing enhanced sampling dynamics simulations, we investigated driving force and thermodynamic barrier adsorption onto Li0.5CoO2 (104) in LiClO4-, LiPF6-, LiTFSI-based EC/EMC (3:7) electrolytes. The weaker cation-anion pairing LiTFSI compared to LiClO4 was found enhance for from -0.48 eV -1.26 an interface with zero cation...

10.26434/chemrxiv-2024-hn926 preprint EN cc-by-nc 2024-05-16

Charge transport in deoxyribonucleic acid (DNA) is of immense interest biology and molecular electronics. Electronic coupling between the DNA bases an important parameter describing efficiency charge DNA. A reasonable estimation this electronic requires many expensive first principle calculations. In article, we present a machine learning (ML) based model to calculate guanine (in same strand) any length, thus avoiding first-principle The are evaluated using density functional theory (DFT)...

10.1021/acs.jpca.0c04368 article EN The Journal of Physical Chemistry A 2020-09-02

In this minireview, we discuss important aspects of the various quantum phenomena (such as interference, spin-dependent charge transport, and thermoelectric effects) relevant in single-molecule transport list some basic circuit rules devised for different molecular systems. These phenomena, conjunction with existing empirical rules, can help predicting structure–property relationships circuits. However, a universal law that predicts properties has not been derived yet. Having such law(s)...

10.1021/acs.nanolett.1c02390 article EN Nano Letters 2021-10-08

Some recent SARS-CoV-2 variants appear to have increased transmissibility compared the original strain. An underlying mechanism could be improved ability of bind receptors on target cells and infect them. In this study, we provide atomic-level insights into binding receptor domain (RBD) wild-type spike protein its single (N501Y), double (E484Q, L452R) triple (N501Y, E484Q, mutated human ACE2 receptor. Using extensive all-atom molecular dynamics simulations advanced free energy calculations,...

10.1039/d1cp04005g article EN Physical Chemistry Chemical Physics 2021-01-01

In this work, using atomistic molecular dynamics (MD) simulations and polymer-assisted ultrafiltration experiments, we explore the adsorption removal of uranyl ions from aqueous solutions poly(amidoamine) (PAMAM) dendrimers. The effects ion concentration pH solution were examined for PAMAM dendrimers generations 3, 4, 5. Our simulation results show that has a high capacity ions. increases with increasing all 3 in agreement experimental findings. We find number bound to is significantly...

10.1021/acs.langmuir.3c00332 article EN Langmuir 2023-05-01

The crucial role of electrolyte cations in CO2 electroreduction has received intensive attention. One prevailing theory is that through electrostatic interactions or direct coordination, larger such as Cs+ can better stabilize the key intermediate species for CO and multicarbon (C2+) product generation, example, on silver copper, respectively. Herein, we show smaller, more acidic alkali metal greatly enhance CO2-to-methanol conversion kinetics (Li+ &gt; Na+ K+ Cs+) an immobilized molecular...

10.26434/chemrxiv-2023-20v8p-v2 preprint EN cc-by-nc-nd 2024-04-24

Copper is an excellent candidate material for next generation of chip-package interconnections because its high electrical and thermal conductivities, good mechanical properties at assembly operating temperatures well-established infrastructure to integrate with back-end processes electroplating technology downscalable nanoscale. This can also accommodate the increasing I/O density future microprocessors best performance. In addition, embedment active components chip-last approach being...

10.1109/ectc.2006.1645632 article EN 2006-07-10

We show the emergence of S-RNA under stretching in analogy to S-DNA and propose a method for its detection using electrical measurement.

10.1039/c8cp03574a article EN Physical Chemistry Chemical Physics 2018-01-01

Double-stranded DNA (dsDNA) has been established as an efficient medium for charge migration, bringing it to the forefront of field molecular electronics and biological research. The migration rate is controlled by electronic couplings between two nucleobases DNA/RNA. These strongly depend on intermolecular geometry orientation. Estimating these all possible relative geometries molecules using computationally demanding first-principles calculations requires a lot time computational...

10.1021/acs.jcim.0c01072 article EN Journal of Chemical Information and Modeling 2020-12-15

Interface engineering remains a largely underexplored area and yet it holds the keys to high performance Li-ion batteries. It is charge transfer across electrode-electrolyte interfaces, its inefficient energetics sluggish kinetics that are oftentimes significant obstacles for achieving fast charging power regimes without compromising battery lifespan. This work propose Boltzmann-averaged first principles workflow based on constant potential constrained density functional theory estimation of...

10.26434/chemrxiv-2024-hh33z preprint EN cc-by 2024-05-17

Interface engineering remains a largely underexplored area and yet it holds the keys to high performance Li-ion batteries. It is charge transfer across electrode-electrolyte interfaces, its inefficient energetics sluggish kinetics that are oftentimes significant obstacles for achieving fast charging power regimes without compromising battery lifespan. This work propose Boltzmann-averaged first principles workflow based on constant potential constrained density functional theory estimation of...

10.26434/chemrxiv-2024-hh33z-v2 preprint EN cc-by 2024-05-21

Enhancing the power of lithium ion batteries necessitates an understanding molecular processes governing Li+ transfer across electrode–electrolyte interface. Here, employing enhanced sampling dynamics simulations, we investigated driving force and thermodynamic barrier adsorption onto Li0.5CoO2 (104) electrode in LiClO4-, LiPF6-, LiTFSI-based EC/EMC (3:7) electrolytes. The weaker cation–anion pairing LiTFSI compared to LiClO4 was found enhance for from −0.48 eV −1.26 interface with zero...

10.1021/acs.jpcc.4c04668 article EN The Journal of Physical Chemistry C 2024-07-30

In this study, we compare the charge transport properties of multiple (double stranded) dsRNA sequences with corresponding dsDNA sequences.

10.1039/d0nr02382e article EN Nanoscale 2020-01-01

Today is the era of high technology and information exchange world. Everyone in need sending or downloading a huge amount data. Further being connected on go all time what people want today. Broadband wireless connectivity homes offices used by users that keep them wire free make accessibility easy fast. to this providing robust, fast reliable network vehicles even aircraft challenge. In paper we explore such talks about aviation aircrafts i.e. Airborne Internet. The idea take facilities...

10.1109/confluence.2017.7943191 article EN 2022 12th International Conference on Cloud Computing, Data Science &amp; Engineering (Confluence) 2017-01-01

In this work we study the structure-transport property relationships of small ligand intercalated DNA molecules using a multiscale modeling approach where extensive ab initio calculations are performed on numerous MD-simulated configurations dsDNA and with two different intercalators, ethidium daunomycin. conductance is found to increase by one order magnitude upon drug intercalation due local unwinding base pairs adjacent sites, which leads modifications density states in near-Fermi-energy...

10.1103/physreve.103.032411 article EN Physical review. E 2021-03-25

This paper describes a simple low cost embedded vision system which has been developed and can satiate the requirement of small in various surveillance control systems applications require an artificial to be them. utilizes CMOS camera module all image data is processed by high speed, AVR microcontroller. The implements processing algorithms taps power microcontrollers with firmware turn also helps reduce hardware cost. being portable used where on board fundamental use traditional not possible.

10.1109/mesa.2008.4735693 article EN 2008-10-01

License plate recognition system is an essential tool for the Traffic Police Department and so, widely being used road traffic surveillance in many countries. This paper aims at locating license any given image, by detecting rectangle like shapes that image. Line grouping algorithm extracts these input image to locate plate. But its accuracy falls sharply images where boundary suffers from occlusions leading broken boundaries. The use of adaptive threshold contours, instead canny edge...

10.1109/icsps.2010.5555574 article EN 2010-07-01
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