PIM-1/Holey graphene oxide mixed matrix membranes for gas separation: unveiling the role of holes

JM Luque-Alled, M Tamaddondar… - … applied materials & …, 2021 - ACS Publications
PIM-1/holey graphene oxide (GO) mixed matrix membranes (MMMs) have been prepared
and their gas separation performance for CO2/CH4 mixtures assessed. Nanopores have …

Chemical functionalization induced photocatalytic performance for water splitting of silicene: A first-principles investigation

G Guo, J Liu, Y Xu, G Guo, S Tan - Colloids and Surfaces A …, 2023 - Elsevier
To expand the application of silicene in the field of optoelectronics, here, the structural and
mechanical stability, electronic, optical and photocatalytic properties of silicene Janus …

The thermoelastic properties of monolayer covalent organic frameworks studied by machine-learning molecular dynamics

B Wang, P Ying, J Zhang - Nanoscale, 2024 - pubs.rsc.org
Two-dimensional (2D) covalent organic frameworks (COFs) are emerging as promising 2D
polymeric materials with broad applications owing to their unique properties, among which …

Stone–Wales Defect Induced Performance Improvement of BC3 Monolayer for High Capacity Lithium-Ion Rechargeable Battery Anode Applications

S Thomas, AK Madam, MA Zaeem - The Journal of Physical …, 2020 - ACS Publications
First-principles density functional theory (DFT) computations were adopted to assess the
potential application of a boron carbide (BC3) monolayer with point and topological defects …

Strain-induced work function in h-BN and BCN monolayers

S Thomas, MS Manju, KM Ajith, SU Lee… - Physica E: Low …, 2020 - Elsevier
In the last decade, research activities of semiconducting two-dimensional (2D) electronic
materials has received widespread attention, and the work function analysis is a significant …

First-principles study on the optoelectronic and photocatalytic properties of the C2h-Janus Al2XY (X/YS, Se and Te) monolayers

G Guo, Y Zhou, G Guo, Z **e - Materials Today Chemistry, 2024 - Elsevier
Abstract Recently, two-dimensional (2D) new C 2h phase of group III monochalcogenides
have exhibited great potentials for applications in the field of photoelectric devices because …

Room-temperature wavelike exciton transport in a van der Waals superatomic semiconductor

JA Tulyagankhodjaev, P Shih, J Yu, JC Russell… - Science, 2023 - science.org
The transport of energy and information in semiconductors is limited by scattering between
electronic carriers and lattice phonons, resulting in diffusive and lossy transport that curtails …

Two-dimensional haeckelite h567: A promising high capacity and fast Li diffusion anode material for lithium-ion batteries

S Thomas, H Jung, S Kim, B Jun, CH Lee, SU Lee - Carbon, 2019 - Elsevier
There is great interest in finding suitable electrode materials for metal-ion batteries with
good performance, low diffusion barriers and high capacity. Using the art of density …

Phographene as a high-performance anode material with high specific capacity and fast Li diffusion: from structural, electronic, and mechanical properties to LIB …

S Thomas, CH Lee, S Jana, B Jun… - The Journal of Physical …, 2019 - ACS Publications
The progress of ecofriendly, clean, and sustainable energy resources always demands
suitable anode materials for batteries with high structural stability and superior storage …

A new planar BCN lateral heterostructure with outstanding strength and defect-mediated superior semiconducting to metallic properties

S Thomas, MA Zaeem - Physical Chemistry Chemical Physics, 2020 - pubs.rsc.org
Motivated by the recent synthesis of boron–carbon–nitride (BCN) monolayers with different
atomic compositions, we propose a novel planar BCN lateral heterostructure with a …