Computational predictions of energy materials using density functional theory

A Jain, Y Shin, KA Persson - Nature Reviews Materials, 2016 - nature.com
In the search for new functional materials, quantum mechanics is an exciting starting point.
The fundamental laws that govern the behaviour of electrons have the possibility, at the …

High-performance triboelectric devices via dielectric polarization: a review

MP Kim, DS Um, YE Shin, H Ko - Nanoscale research letters, 2021 - Springer
Energy harvesting devices based on the triboelectric effect have attracted great attention
because of their higher output performance compared to other nanogenerators, which have …

Accelerating materials property predictions using machine learning

G Pilania, C Wang, X Jiang, S Rajasekaran… - Scientific reports, 2013 - nature.com
The materials discovery process can be significantly expedited and simplified if we can learn
effectively from available knowledge and data. In the present contribution, we show that …

Advanced polymeric dielectrics for high energy density applications

TD Huan, S Boggs, G Teyssedre, C Laurent… - Progress in Materials …, 2016 - Elsevier
This article provides an overview of the present state-of-the-art pertaining to polymer
capacitor dielectrics appropriate for high electrostatic energy density applications. The …

[HTML][HTML] Machine learning strategy for accelerated design of polymer dielectrics

A Mannodi-Kanakkithodi, G Pilania, TD Huan… - Scientific reports, 2016 - nature.com
The ability to efficiently design new and advanced dielectric polymers is hampered by the
lack of sufficient, reliable data on wide polymer chemical spaces and the difficulty of …

Machine Learning Assisted Predictions of Intrinsic Dielectric Breakdown Strength of ABX3 Perovskites

C Kim, G Pilania, R Ramprasad - The Journal of Physical …, 2016 - ACS Publications
New and improved dielectric materials with high dielectric breakdown strength are required
for both high energy density electric energy storage applications and continued …

Dielectric polymers with novel chemistry, compositions and architectures

Y Qiao, X Yin, T Zhu, H Li, C Tang - Progress in Polymer Science, 2018 - Elsevier
Dielectric capacitors have attracted ever-increasing interest in recent decades for numerous
applications in modern electronic and electrical power systems due to their fast …

Rational co‐design of polymer dielectrics for energy storage

A Mannodi‐Kanakkithodi, GM Treich… - Advanced …, 2016 - Wiley Online Library
Although traditional materials discovery has historically benefited from intuition‐driven
experimental approaches and serendipity, computational strategies have risen in …

Computational strategies for polymer dielectrics design

CC Wang, G Pilania, SA Boggs, S Kumar, C Breneman… - Polymer, 2014 - Elsevier
The present contribution provides a perspective on the degree to which modern
computational methods can be harnessed to guide the design of polymeric dielectrics. A …

Research progress of all organic polymer dielectrics for energy storage from the classification of organic structures

J Luo, J Mao, W Sun, S Wang, L Zhang… - Macromolecular …, 2021 - Wiley Online Library
Dielectric films are the foundation of power electronic equipment for energy storage in
capacitors. However, typical dielectric films exhibit undesirable energy storage density and …