Solvation structure and energetics of electrolytes for multivalent energy storage

Literature Information

Publication Date 2014-09-10
DOI 10.1039/C4CP03015J
Impact Factor 3.676
Authors

Saul H. Lapidus, Nav Nidhi Rajput, Xiaohui Qu, Karena W. Chapman, Kristin A. Persson, Peter J. Chupas


View Original

Abstract

By analysing X-ray pair distribution function data using a multivariate statistical approach, we isolate the cation solvation structure for monovalent (Li+/Na+/K+) and multivalent (Mg2+/Ca2+/Zn2+) electrolytes based on TFSI salts in diglyme. Parallel molecular dynamics simulations provide enhanced structural details. The data suggest that contact ion-pairs are a common feature in multivalent electrolytes.

Related Literature

Kinetic features of solvent extraction by N,O-donor ligands of f-elements: a comparative study of diamides based on 1,10-phenanthroline and 2,2′-bipyridine

Ekaterina A. Konopkina, Alexander V. Gopin, Anton S. Pozdeev, Maria G. Chernysheva, Paulina Kalle, Elizaveta A. Pavlova, Stepan N. Kalmykov, Vladimir G. Petrov, Nataliya E. Borisova, Alexander A. Guda, Petr I. Matveev

2023-12-18 Paper

DOI: 10.1039/D3CP05081E

Tunable Li-ion diffusion properties in MoSSe bilayer anodes by strain gradient

Li Zhong, Xiaobao Li, Yuxue Pu, Meiqin Wang, Chunxiao Zhan, Xinle Xiao

2023-11-30 Paper

DOI: 10.1039/D3CP04650H

The effect of temperature and oxygen partial pressure on the concentration of iron and manganese ions in La1/3Sr2/3Fe1−xMnxO3−δ

Sergey S. Nikitin, Alexander D. Koryakov, Elizaveta A. Antipinskaya, Mikhail V. Patrakeev

2023-12-15 Paper

DOI: 10.1039/D3CP05421G

Carbon doped hexagonal boron nitride as an efficient metal-free catalyst for NO capture and reduction

Jiali Nie, Ying Li, Dongyue Gao, Yi Fang, Jing Lin, Chengchun Tang, Zhonglu Guo

2023-12-15 Paper

DOI: 10.1039/D3CP04718K

Dendrite-free deposition and side-reaction suppression of zinc anodes achieved via constructing synergistic interface buffer layers

Ting Li, Zhongfu Yan, Mengjiao Liu, Xinyu Liu, Liang Liu, Jiahao Chen, Jianping Long

2023-12-09 Paper

DOI: 10.1039/D3SE01334K

Dense arrangement of crown ethers in graphene: novel graphitic carbon oxides with enhanced optoelectronic properties

Hongyan Li, Jiang Xiang, Jing Xu, Wei Liu

2023-12-12 Paper

DOI: 10.1039/D3CP03902A

Front cover

2024-01-03 Cover

DOI: 10.1039/D4CP90006E

Effect of substituting donors on the hole mobility of hole transporting materials in perovskite solar cells: a DFT study

Md Al Mamunur Rashid, Sein Min, Sung Keon Namgoong, Keunhong Jeong

2023-12-04 Paper

DOI: 10.1039/D3CP04310J

Contents list

2023-12-21 Front/Back Matter

DOI: 10.1039/D4CP90003K

You might also like

Compound Q&A

How should waste containing N-Methoxy-N-methyl-1,3-thiazole-5-carboxamide (CAS: 898825-89-3) be handled?

Waste containing N-Methoxy-N-methyl-1,3-thiazole-5-carboxamide (CAS: 898825-89-3...

898825-89-3N-Methoxy-N-methyl-1...
Compound Q&A

How should N-(4-Biphenylyl)dibenzo[b,d]furan-4-amine (CAS: 1318338-47-4) be stored?

N-(4-Biphenylyl)dibenzo[b,d]furan-4-amine should be stored in a tightly sealed c...

1318338-47-4N-(4-Biphenylyl)dibe...
Compound Q&A

What is the market or research trend for 3-Acetamido-5-amino-2,4,6-triiodobenzoic acid (CAS: 1713-07-1)?

The market for 3-Acetamido-5-amino-2,4,6-triiodobenzoic acid (CAS: 1713-07-1) is...

1713-07-13-Acetamido-5-amino-...
Compound Q&A

How should Benzyl 2-O-acetyl-3,4,6-tri-O-benzyl-beta-D-galactopyranoside (CAS: 61820-03-9) be stored?

Benzyl 2-O-acetyl-3,4,6-tri-O-benzyl-beta-D-galactopyranoside (CAS: 61820-03-9) ...

61820-03-9Benzyl 2-O-acetyl-3,...
Compound Q&A

What regulatory guidelines apply to 2-Ethylpiperazine dihydrochloride (CAS: 438050-52-3)?

2-Ethylpiperazine dihydrochloride (CAS: 438050-52-3) is regulated under the Glob...

438050-52-32-Ethylpiperazine di...
Compound Q&A

What regulatory guidelines apply to 1,1'-[1,3-Phenylenebis(methylene)]bis(3-methyl-1H-pyrrole-2,5-dione) (CAS: 119462-56-5)?

1,1'-[1,3-Phenylenebis(methylene)]bis(3-methyl-1H-pyrrole-2,5-dione) (CAS: 11946...

119462-56-51,1'-[1,3-Phenyleneb...
Compound Q&A

Are there alternatives to 5-Fluoro-2-(1-pyrrolidinyl)pyridine (CAS: 1287217-79-1) in synthesis?

Several alternatives can be used in the synthesis of 5-Fluoro-2-(1-pyrrolidinyl)...

1287217-79-15-Fluoro-2-(1-pyrrol...
Compound Q&A

What precautions should be taken when handling 6-Bromoimidazo[1,2-a]pyridin-8-amine (CAS: 676371-00-9)?

When handling 6-Bromoimidazo[1,2-a]pyridin-8-amine, it is important to wear appr...

676371-00-96-Bromoimidazo[1,2-a...
Compound Q&A

Are there alternatives to (2S,4R)-4-(4-Nitrobenzyl)pyrrolidine-2-carboxylic acid hydrochloride (CAS: 1049740-22-8) in synthesis?

Alternatives to (2S,4R)-4-(4-Nitrobenzyl)pyrrolidine-2-carboxylic acid hydrochlo...

1049740-22-8(2S,4R)-4-(4-Nitrobe...

Source Journal

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

Recommended Compounds

Recommended Suppliers

Disclaimer
This page provides academic journal information for reference and research purposes only. We are not affiliated with any journal publishers and do not handle publication submissions. For publication-related inquiries, please contact the respective journal publishers directly.
If you notice any inaccuracies in the information displayed, please contact us at support@chemtradehub.com. We will promptly review and address your concerns.