Concept of embedded dipoles as a versatile tool for surface engineering

E Zojer, A Terfort, M Zharnikov - Accounts of Chemical Research, 2022 - ACS Publications
Conspectus Controlling the physical and chemical properties of surfaces and interfaces is of
fundamental relevance in various areas of physical chemistry and a key issue of modern …

Poled polymers and their nonlinear optics

L Yu, Y Wang, S Zhan, D Chen, S Wang… - Journal of Materials …, 2023 - pubs.rsc.org
In recent years, poled polymers have attracted great interest due to their applications in
optics, physics, chemistry, biology, and medicine. Organic second order nonlinear optical …

Growth mechanisms and anisotropic softness–dependent conductivity of orientation-controllable metal–organic framework nanofilms

MS Yao, K Otake, T Koganezawa… - Proceedings of the …, 2023 - National Acad Sciences
Conductive metal–organic frameworks (c MOFs) manifest great potential in modern
electrical devices due to their porous nature and the ability to conduct charges in a regular …

[HTML][HTML] Intramolecular charge transfer for optical applications

PK Samanta, R Misra - Journal of Applied Physics, 2023 - pubs.aip.org
Tuning of intramolecular charge transfer (ICT) in a molecule could be used to modulate its
linear and nonlinear optical (NLO) response properties. Over the years, the ICT process in …

A Multi‐Scale Approach to Simulate the Nonlinear Optical Response of Molecular Nanomaterials

B Zerulla, D Beutel, C Holzer… - Advanced …, 2024 - Wiley Online Library
Nonlinear optics is essential for many recent photonic technologies. Here, a novel multi‐
scale approach is introduced to simulate the nonlinear optical response of molecular …

Exploring functional photonic devices made from a chiral metal–organic framework material by a multiscale computational method

B Zerulla, C Li, D Beutel, S Oßwald… - Advanced Functional …, 2024 - Wiley Online Library
Electronic circular dichroism is an important optical phenomenon offering insights into chiral
molecular materials. On the other hand, metal–organic frameworks (MOFs) are a novel …

[HTML][HTML] Electro-capillary peeling of thin films

P Li, X Huang, YP Zhao - Nature Communications, 2023 - nature.com
Thin films are widely-used functional materials that have attracted much interest in academic
and industrial applications. With thin films becoming micro/nanoscale, developing a simple …

Metal‐organic Frameworks in Semiconductor Devices

RK Parashar, P Jash, M Zharnikov… - Angewandte Chemie …, 2024 - Wiley Online Library
Metal‐organic frameworks (MOFs) are a specific class of hybrid, crystalline, nano‐porous
materials made of metal‐ion‐based 'nodes' and organic linkers. Most of the studies on MOFs …

Electrostatically Designing Materials and Interfaces

E Zojer - Advanced Materials, 2024 - Wiley Online Library
Collective electrostatic effects arise from the superposition of electrostatic potentials of
periodically arranged (di) polar entities and are known to crucially impact the electronic …

[HTML][HTML] Tuning the electrostatic energy landscape within the pores of covalent organic frameworks: post-synthetic modification reactions and structural imperfections

E Zojer - Journal of Materials Chemistry A, 2024 - pubs.rsc.org
It is well established that collective electrostatic effects resulting from the periodic
arrangement of polar entities determine the energy-level alignment at conventional, 2D …