skip to main content
US FlagAn official website of the United States government
dot gov icon
Official websites use .gov
A .gov website belongs to an official government organization in the United States.
https lock icon
Secure .gov websites use HTTPS
A lock ( lock ) or https:// means you've safely connected to the .gov website. Share sensitive information only on official, secure websites.


Search for: All records

Creators/Authors contains: "Acharya, Narayan"

Note: When clicking on a Digital Object Identifier (DOI) number, you will be taken to an external site maintained by the publisher. Some full text articles may not yet be available without a charge during the embargo (administrative interval).
What is a DOI Number?

Some links on this page may take you to non-federal websites. Their policies may differ from this site.

  1. Free, publicly-accessible full text available November 11, 2025
  2. Abstract Using both density functional theory (DFT+U) simulations and experiments, we show that the incorporation of an ordered array of oxygen‐vacancies in a perovskite oxide can lead to enhancement of the electrocatalytic activity for the oxygen‐evolution reaction (OER). As a benchmark, LaCoO3was investigated, where the incorporation of oxygen‐vacancies led to La3Co3O8(LaCoO2.67), featuring a structural transformation. DFT+U simulations demonstrated the effect of oxygen‐vacancies on lowering the potential required to achieve negative Gibbs Free Energy for all steps of the OER mechanism. This was also confirmed by experiments, where the vacancy‐ordered catalyst La3Co3O8(LaCoO2.67) showed a remarkable enhancement of electrocatalytic properties over the parent compound LaCoO3that lacked vacancies. We also synthesized and studied an intermediate system, with a smaller degree of oxygen‐vacancies, which showed intermediate electrocatalytic activity, lower than La3Co3O8and higher than LaCoO3, confirming the expected trend and the impact of oxygen‐vacancies. Furthermore, we employed additional DFT+U calculations to simulate a hypothetical material with the same formula as La3Co3O8but without the vacancy‐order. We found that the gap between centers of Codand Opbands, which is considered an OER descriptor, would be significantly greater for a hypothetical disordered material compared to an ordered system. 
    more » « less
  3. null (Ed.)
    We present a query-based biomedical information retrieval task across two vastly different genres -- newswire and research literature -- where the goal is to find the research publication that supports the primary claim made in a health-related news article. For this task, we present a new dataset of 5,034 claims from news paired with research abstracts. Our approach consists of two steps: (i) selecting the most relevant candidates from a collection of 222k research abstracts, and (ii) re-ranking this list. We compare the classical IR approach using BM25 with more recent transformer-based models. Our results show that cross-genre medical IR is a viable task, but incorporating domain-specific knowledge is crucial. 
    more » « less