skip to main content


Search for: All records

Creators/Authors contains: "Klie, Robert F."

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 December 1, 2024
  2. Solid-state reactions formed vertical carpets of 2D metal carbides and nitrides on metal substrates. 
    more » « less
  3. Abstract

    Identifying point defects and other structural anomalies using scanning transmission electron microscopy (STEM) is important to understand a material's properties caused by the disruption of the regular pattern of crystal lattice. Due to improvements in instrumentation stability and electron optics, atomic‐resolution images with a field of view of several hundred nanometers can now be routinely acquired at 1–10 Hz frame rates and such data, which often contain thousands of atomic columns, need to be analyzed. To date, image analysis is performed largely manually, but recent developments in computer vision (CV) and machine learning (ML) now enable automated analysis of atomic structures and associated defects. Here, the authors report on how a Convolutional Variational Autoencoder (CVAE) can be utilized to detect structural anomalies in atomic‐resolution STEM images. Specifically, the training set is limited to perfect crystal images , and the performance of a CVAE in differentiating between single‐crystal bulk data or point defects is demonstrated. It is found that the CVAE can reproduce the perfect crystal data but not the defect input data. The disagreesments between the CVAE‐predicted data for defects allows for a clear and automatic distinction and differentiation of several point defect types.

     
    more » « less
  4. null (Ed.)
  5. null (Ed.)
    V 2 O 5 is of interest as a Mg intercalation electrode material for Mg batteries, both in its thermodynamically stable layered polymorph (α-V 2 O 5 ) and in its metastable tunnel structure (ζ-V 2 O 5 ). However, such oxide cathodes typically display poor Mg insertion/removal kinetics, with large voltage hysteresis. Herein, we report the synthesis and evaluation of nanosized ( ca . 100 nm) ζ-V 2 O 5 in Mg-ion cells, which displays significantly enhanced electrochemical kinetics compared to microsized ζ-V 2 O 5 . This effect results in a significant boost in stable discharge capacity (130 mA h g −1 ) compared to bulk ζ-V 2 O 5 (70 mA h g −1 ), with reduced voltage hysteresis (1.0 V compared to 1.4 V). This study reveals significant advancements in the use of ζ-V 2 O 5 for Mg-based energy storage and yields a better understanding of the kinetic limiting factors for reversible magnesiation reactions into such phases. 
    more » « less