Publications related to Crystal growth

Supramolecular interactions using β-cyclodextrin in controlling perovskite solar cell performance

Kevin Sivula, Jun Ho Yum, Parnian Ferdowsi, Jiyoun Seo

In the context of perovskite solar cells (PSCs), enhancing device performance often involves adding a small excess of lead iodide (PbI2) to the precursor solution. However, the presence of unreacted PbI2 can lead to accelerated degradation compromising lon ...

Royal Society of Chemistry2024

The molecular scale mechanism of deposition ice nucleation on silver iodide

Athanasios Nenes, Mária Lbadaoui-Darvas, André Welti

Heterogeneous ice nucleation is a ubiquitous process in the natural and built environment. Deposition ice nucleation, i.e. heterogeneous ice nucleation that - according to the traditional view - occurs in a subsaturated water vapor environment and in the a ...

Royal Soc Chemistry2024

Crystallization of FAPbI3: Polytypes and stacking faults

Paramvir Ahlawat

Molecular dynamics simulations are performed to study the crystallization of formamidinium lead iodide. From all-atom simulations of the crystal growth process and the delta-alpha-phase transitions, we try to reveal the formation of various stack-faulted i ...

Aip Publishing2023

Selectively permeable microcapsules

Chuen-Ru Li

Microcapsules are appealing containers for delivering active ingredients, such as drugs and cosmetics, or conducting chemical and biological reactions on a small scale. To control the timing and location of release of these encapsulants, the shells of micr ...

EPFL2023

RaFSIP: Parameterizing ice multiplication in models using a machine learning approach

Athanasios Nenes, Paraskevi Georgakaki

Accurately representing mixed-phase clouds (MPCs) in global climate models (GCMs) is critical for capturing climate sensitivity and Arctic amplification. Secondary ice production (SIP), can significantly increase ice crystal number concentration (ICNC) in ...

2024

Microfluidic study in a meter-long reactive path reveals how the medium’s structural heterogeneity shapes MICP-induced biocementation

Lyesse Laloui, Dimitrios Terzis, Ariadni Elmaloglou

Microbially induced calcium carbonate (CaCO3) precipitation (MICP) is one of the major sustainable alternatives to the artificial cementation of granular media. MICP consists of injecting the soil with bacterial- and calcium-rich solutions sequentially to ...

Nature Research2022

Site-selective overgrowth of Ag nanocrystals by Polyvinylpyrrolidone-mediated atom deposition by Ostwald ripening

Francesco Stellacci, Paulo Henrique Jacob Silva, Alejandro Lapresta Fernandez

The growth modulation of metal nanocrystals (NCs) by Ostwald ripening (OR) involves control of the relocation of matter by diffusional mass transfer from the dissolution of small nanocrystals (SNCs) towards large nanocrystals whose surface energy is lower. ...

ELSEVIER2022

Electrical Spectroscopy of Defect States in Synthetic 2D Materials

Yanfei Zhao

Two-dimensional (2D) materials such as graphene and transition metal dichalcogenide (TMDC) are considered as one of the most promising material platforms for future electronic devices, due to their ultra-thin thickness and fascinating electrical and optica ...

EPFL2022

Investigation of new particle formation mechanisms and aerosol processes at Marambio Station, Antarctic Peninsula

Lubna Dada

Understanding chemical processes leading to the formation of atmospheric aerosol particles is crucial to improve our capabilities in predicting the future climate. However, those mechanisms are still inadequately characterized, especially in polar regions. ...

Copernicus GmbH2022

Buffered Coordination Modulation as a Means of Controlling Crystal Morphology and Molecular Diffusion in an Anisotropic Metal-Organic Framework

Berend Smit, Sudabeh Jawahery

Significant advances have been made in the synthesis of chemically selective environments within metal-organic frameworks, yet materials development and industrial implementation have been hindered by the inability to predictively control crystallite size ...

AMER CHEMICAL SOC2021

Self-consistent Hubbard parameters from density-functional perturbation theory in the ultrasoft and projector-augmented wave formulations

Nicola Marzari, Iurii Timrov, Matteo Cococcioni

The self-consistent evaluation of Hubbard parameters using linear-response theory is crucial for quantitatively predictive calculations based on Hubbard-corrected density-functional theory. Here, we extend a recently introduced approach based on density-fu ...

AMER PHYSICAL SOC2021

Fabrication of Single-Crystalline InSb-on-Insulator by Rapid Melt Growth

Anna Fontcuberta i Morral, Nicholas Paul Morgan, Heera Menon

InSb has the smallest bandgap and highest electron mobility among III-V semiconductors and is widely used for photodetectors and high-frequency electronic applications. Integration of InSb directly on Si would drastically reduce the fabrication cost and en ...

Wiley2021

Dion-Jacobson and Ruddlesden-Popper double-phase 2D perovskites for solar cells

Bowen Yang, Yang Liu, Chen Li, Xin Guo, Sajjad Ahmad

Dion-Jacobson (DJ) phase and Ruddlesden-Popper phase 2D perovskites have been, individually, demonstrated to be more stable than 3D counterparts for perovskite solar cells (PSCs). In order to further improve the efficiency and stability of 2D PSCs, we here ...

Elsevier2021

Secondary ice production in summer clouds over the Antarctic coast: an underappreciated process in atmospheric models

Athanasios Nenes, Alexis Berne, Georgia Sotiropoulou, Etienne Gabriel Henri Vignon

The correct representation of Antarctic clouds in atmospheric models is crucial for accurate projections of the future Antarctic climate. This is particularly true for summer clouds which play a critical role in the surface melting of the ice shelves in th ...

European Geosciences Union2021

Identification of snowfall microphysical processes from Eulerian vertical gradients of polarimetric radar variables

Alexis Berne, Josué Etienne Gehring, Etienne Gabriel Henri Vignon, Noémie Planat

Polarimetric radar systems are commonly used to study the microphysics of precipitation. While they offer continuous measurements with a large spatial coverage, retrieving information about the microphysical processes that govern the evolution of snowfall ...

COPERNICUS GESELLSCHAFT MBH2021

Progress in modelling solidification microstructures in metals and alloys. Part II: dendrites from 2001 to 2018

Michel Rappaz, Wilfried Kurz

This is the first account of the history of modelling dendritic and cellular solidification. While Part I reviewed the progress up to the year 2000 [Kurz W, Fisher DJ, Trivedi R. Progress in modelling solidification microstructures in metals and alloys: de ...

TAYLOR & FRANCIS LTD2021

Influence of Minor Cr Additions on Crystal Growth in Rapidly Solidified Al-20Zn Alloys

Michel Rappaz

It has been discovered quite recently that Icosahedral Short-Range Order (ISRO) of atoms in the liquid phase of metallic alloys surrounding some trace elements added to the melt can influence both the nucleation and growth of the primary phase. In this wor ...

2020

3D Ordering at the Liquid-Solid Polar Interface of Nanowires

Anna Fontcuberta i Morral, Michele Ceriotti, Cécile Hébert, Duncan Thomas Lindsay Alexander, Gözde Tütüncüoglu, Martin George Friedl, Luca Francaviglia, Mahdi Zamani, Nicolas Tappy, Giulio Imbalzano, Sara Marti Sanchez, Lea Ghisalberti

The nature of the liquid-solid interface determines the characteristics of a variety of physical phenomena, including catalysis, electrochemistry, lubrication, and crystal growth. Most of the established models for crystal growth are based on macroscopic t ...

Wiley2020

The impact of secondary ice production on Arctic stratocumulus

Athanasios Nenes, Georgia Sotiropoulou

In situ measurements of Arctic clouds frequently show that ice crystal number concentrations (ICNCs) are much higher than the number of available ice-nucleating particles (INPs), suggesting that secondary ice production (SIP) may be active. Here we use a L ...

Copernicus GmbH2020

Atomistic modeling of the solid-liquid interface of metals and alloys

Edoardo Baldi

Solidification is a phase transformation of utmost importance in material science, for it largely controls materials' microstructure on which a wide range of mechanical properties depends. Almost every human artifact undergoes a transformation that leads t ...

EPFL2020