4.7 Article

Complex Structure of Molten NaCl-CrCl3 Salt: Cr-Cl Octahedral Network and Intermediate-Range Order

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Chemistry, Multidisciplinary

Development of robust neural-network interatomic potential for molten salt

Qing-Jie Li et al.

Summary: Molten salts are a type of ionic liquids used in clean energy applications, and artificial neural networks can accurately model their properties, achieving high efficiency in atomistic simulations.

CELL REPORTS PHYSICAL SCIENCE (2021)

Article Chemistry, Physical

Temperature Dependence of Short and Intermediate Range Order in Molten MgCl2 and Its Mixture with KCl

Fei Wu et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2020)

Article Chemistry, Physical

Elucidating Ionic Correlations Beyond Simple Charge Alternation in Molten MgCl2-KCI Mixtures

Fei Wu et al.

JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2019)

Article Chemistry, Physical

First-Principles Molecular Dynamics Simulations of UCln-NaCl (n=3, 4) Molten Salts

Bo Li et al.

ACS APPLIED ENERGY MATERIALS (2019)

Review Materials Science, Multidisciplinary

Aggregation and data analysis of corrosion studies in molten chloride and fluoride salts

Stephen S. Raiman et al.

JOURNAL OF NUCLEAR MATERIALS (2018)

Article Materials Science, Multidisciplinary

First-principles molecular dynamics modeling of the LiCl-KCl molten salt system

Amelia Bengtson et al.

COMPUTATIONAL MATERIALS SCIENCE (2014)

Article Materials Science, Multidisciplinary

First-principles molecular dynamics modeling of the molten fluoride salt with Cr solute

H. O. Nam et al.

JOURNAL OF NUCLEAR MATERIALS (2014)

Article Electrochemistry

Solubility of Sodium in Sodium Chloride: A Density Functional Theory Molecular Dynamics Study

Maoyuan Liu et al.

JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2014)

Article Instruments & Instrumentation

The Nanoscale Ordered MAterials Diffractometer NOMAD at the Spallation Neutron Source SNS

Joerg Neuefeind et al.

NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS (2012)

Article Chemistry, Multidisciplinary

PACKMOL: A Package for Building Initial Configurations for Molecular Dynamics Simulations

L. Martinez et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2009)

Article Nuclear Science & Technology

Coupled dynamics in the physics of molten salt reactors

Claudio Nicolino et al.

ANNALS OF NUCLEAR ENERGY (2008)

Article Chemistry, Analytical

Melting and vaporization of salts in a U-LiCl-Li2O system

J. M. Hur et al.

JOURNAL OF RADIOANALYTICAL AND NUCLEAR CHEMISTRY (2006)

Article Chemistry, Multidisciplinary

Semiempirical GGA-type density functional constructed with a long-range dispersion correction

Stefan Grimme

JOURNAL OF COMPUTATIONAL CHEMISTRY (2006)

Article Multidisciplinary Sciences

Breakdown of intermediate-range order in liquid GeSe2 at high pressure

WA Crichton et al.

NATURE (2001)