Tin (Sn) at high pressure: Review, X-ray diffraction, DFT calculations, and Gibbs energy modeling

G Deffrennes, P Faure, F Bottin, JM Joubert… - Journal of Alloys and …, 2022 - Elsevier
An assessment of the Sn unary system is presented. First, the literature on phase equilibria,
the thermodynamic properties, the volume and related properties, and shock compression of …

Metastable water at several compression rates and its freezing kinetics into ice VII

CM Pépin, R André, F Occelli, F Dembele… - Nature …, 2024 - nature.com
Water can be dynamically over-compressed well into the stability field of ice VII. Whether
water then transforms into ice VII, vitreous ice or a metastable novel crystalline phase …

In situ synchrotron X-ray diffraction in the laser-heated diamond anvil cell: Melting phenomena and synthesis of new materials

A Salamat, RA Fischer, R Briggs, MI McMahon… - Coordination Chemistry …, 2014 - Elsevier
The ability to produce high pressures and temperatures (P–T), and study the physical and
chemical properties of solids and melts at these conditions, is possible through the use of …

Cobalt Do** in MOF-Derived Carbon-Loaded Tin Nanomaterials for Enhanced Electrocatalytic CO2 Reduction

S Ma, K Wu, F Xu, S Fan, P Yang, J Ma - Energy & Fuels, 2024 - ACS Publications
Among many catalysts for the electrochemical reduction of CO2, bimetallic materials have
been paid more attention on enhanced catalytic activity and product selectivity. Sn is …

Prediction of stable Li-Sn compounds: boosting ab initio searches with neural network potentials

S Kharabadze, A Thorn, EA Koulakova… - npj Computational …, 2022 - nature.com
Abstract The Li-Sn binary system has been the focus of extensive research because it
features Li-rich alloys with potential applications as battery anodes. Our present re …

X-ray diffraction of solid tin to 1.2 TPa

A Lazicki, JR Rygg, F Coppari, R Smith… - Physical review …, 2015 - APS
We report direct in situ measurements of the crystal structure of tin between 0.12 and 1.2
TPa, the highest stress at which a crystal structure has ever been observed. Using angle …

MAGRATHEA: an open-source spherical symmetric planet interior structure code

C Huang, DR Rice, JH Steffen - Monthly Notices of the Royal …, 2022 - academic.oup.com
ABSTRACT MAGRATHEA is an open-source planet structure code that considers the case
of fully differentiated spherically symmetric interiors. Given the mass of each layer and the …

Machine learning search for stable binary Sn alloys with Na, Ca, Cu, Pd, and Ag

A Thorn, D Gochitashvili, S Kharabadze… - Physical Chemistry …, 2023 - pubs.rsc.org
We present our findings of a large-scale screening for new synthesizable materials in five M–
Sn binaries, M= Na, Ca, Cu, Pd, and Ag. The focus on these systems was motivated by the …

Multiphase tin equation of state using density functional theory

DA Rehn, CW Greeff, L Burakovsky, DG Sheppard… - Physical Review B, 2021 - APS
We perform density functional theory (DFT) calculations of five solid phases and the liquid
phase of tin. The calculations include cold curves of the five solid phases, phonon …

Modeling the high-pressure solid and liquid phases of tin from deep potentials with ab initio accuracy

T Chen, F Yuan, J Liu, H Geng, L Zhang, H Wang… - Physical Review …, 2023 - APS
Constructing an accurate atomistic model for the high-pressure phases of tin (Sn) is
challenging because the properties of Sn are sensitive to pressures. We develop machine …