Search Results - "Subramanian, K S"
-
1
Operando tribochemical formation of onion-like-carbon leads to macroscale superlubricity
Published in Nature communications (21-03-2018)“…Stress-induced reactions at the sliding interface during relative movement are known to cause structural or chemical modifications in contacting materials. The…”
Get full text
Journal Article -
2
Machine learning coarse grained models for water
Published in Nature communications (22-01-2019)“…An accurate and computationally efficient molecular level description of mesoscopic behavior of ice-water systems remains a major challenge. Here, we introduce…”
Get full text
Journal Article -
3
Reconfigurable perovskite nickelate electronics for artificial intelligence
Published in Science (American Association for the Advancement of Science) (04-02-2022)“…Reconfigurable devices offer the ability to program electronic circuits on demand. In this work, we demonstrated on-demand creation of artificial neurons,…”
Get full text
Journal Article -
4
Controlled-release fertilizer of zinc encapsulated by a manganese hollow core shell
Published in Soil science and plant nutrition (Tokyo) (04-03-2015)“…A laboratory study was undertaken to regulate the release of zinc (Zn) to the soil–plant system using a nano-sized manganese hollow core shell. The manganese…”
Get full text
Journal Article -
5
Machine Learning Force Field Parameters from Ab Initio Data
Published in Journal of chemical theory and computation (12-09-2017)“…Machine learning (ML) techniques with the genetic algorithm (GA) have been applied to determine a polarizable force field parameters using only ab initio data…”
Get full text
Journal Article -
6
Machine learning enabled autonomous microstructural characterization in 3D samples
Published in npj computational materials (06-01-2020)“…We introduce an unsupervised machine learning (ML) based technique for the identification and characterization of microstructures in three-dimensional (3D)…”
Get full text
Journal Article -
7
Active site localization of methane oxidation on Pt nanocrystals
Published in Nature communications (24-08-2018)“…High catalytic efficiency in metal nanocatalysts is attributed to large surface area to volume ratios and an abundance of under-coordinated atoms that can…”
Get full text
Journal Article -
8
Habituation based synaptic plasticity and organismic learning in a quantum perovskite
Published in Nature communications (14-08-2017)“…A central characteristic of living beings is the ability to learn from and respond to their environment leading to habit formation and decision making. This…”
Get full text
Journal Article -
9
Role of Solvation Dynamics and Local Ordering of Water in Inducing Conformational Transitions in Poly(N-isopropylacrylamide) Oligomers through the LCST
Published in The journal of physical chemistry. B (08-03-2012)“…Conformational transitions in thermo-sensitive polymers are critical in determining their functional properties. The atomistic origin of polymer collapse at…”
Get full text
Journal Article -
10
Learning in continuous action space for developing high dimensional potential energy models
Published in Nature communications (18-01-2022)“…Reinforcement learning (RL) approaches that combine a tree search with deep learning have found remarkable success in searching exorbitantly large, albeit…”
Get full text
Journal Article -
11
Ab Initio-Based Bond Order Potential to Investigate Low Thermal Conductivity of Stanene Nanostructures
Published in The journal of physical chemistry letters (06-10-2016)“…We introduce a bond order potential (BOP) for stanene based on an ab initio derived training data set. The potential is optimized to accurately describe the…”
Get full text
Journal Article -
12
Removal of Non-Specifically Bound Proteins Using Rayleigh Waves Generated on ST-Quartz Substrates
Published in Sensors (Basel, Switzerland) (28-05-2022)“…Label-free biosensors are plagued by the issue of non-specific protein binding which negatively affects sensing parameters such as sensitivity, selectivity,…”
Get full text
Journal Article -
13
Phase Segmentation in Atom-Probe Tomography Using Deep Learning-Based Edge Detection
Published in Scientific reports (27-12-2019)“…Atom-probe tomography (APT) facilitates nano- and atomic-scale characterization and analysis of microstructural features. Specifically, APT is well suited to…”
Get full text
Journal Article -
14
Perovskite nickelates as bio-electronic interfaces
Published in Nature communications (10-04-2019)“…Functional interfaces between electronics and biological matter are essential to diverse fields including health sciences and bio-engineering. Here, we report…”
Get full text
Journal Article -
15
Accurate determination of solvation free energies of neutral organic compounds from first principles
Published in Nature communications (20-01-2022)“…The main goal of molecular simulation is to accurately predict experimental observables of molecular systems. Another long-standing goal is to devise models…”
Get full text
Journal Article -
16
Thermomechanical Response of Self-Assembled Nanoparticle Membranes
Published in ACS nano (22-08-2017)“…Monolayers composed of colloidal nanoparticles, with a thickness of less than 10 nm, have remarkable mechanical moduli and can suspend over micrometer-sized…”
Get full text
Journal Article -
17
High-Entropy 2D Carbide MXenes: TiVNbMoC3 and TiVCrMoC3
Published in ACS nano (24-08-2021)“…Two-dimensional (2D) transition metal carbides and nitrides, known as MXenes, are a fast-growing family of 2D materials. MXenes 2D flakes have n + 1 (n = 1–4)…”
Get full text
Journal Article -
18
Alloy-assisted deposition of three-dimensional arrays of atomic gold catalyst for crystal growth studies
Published in Nature communications (08-12-2017)“…Large-scale assembly of individual atoms over smooth surfaces is difficult to achieve. A configuration of an atom reservoir, in which individual atoms can be…”
Get full text
Journal Article -
19
Arsenic removal from drinking water using iron oxide-coated sand
Published in Water, air, and soil pollution (2003)“…This article describes experiments in which iron oxide-coated sand(IOCS) was used to study the removal of both As(V) and As(III) to a level less than 5 μg…”
Get full text
Journal Article -
20
Responses of field grown tomato plants to arbuscular mycorrhizal fungal colonization under varying intensities of drought stress
Published in Scientia horticulturae (06-02-2006)“…The effects of root colonization by the arbuscular mycorrhizal (AM) fungus Glomus intraradices Schenck and Smith on growth, flower and fruit production, and…”
Get full text
Journal Article