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Shamik Chakrabarti

Indian Institute of Technology Patna

H指数:11

被引数:413

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Effect of Mg doping on electrochemical properties of AMO₂ (with A=Li/Na and M= Mn/Fe//Ni) type electrode materials - a density functional theory study

Mg掺杂对AMO<sub>2</sub>（A=Li/Na，M=Mn/Fe//Ni）型电极材料电化学性能的影响——密度泛函理论研究

Computational Condensed Matter

IF3.9

2026-09-290

PRE

Anionic redox response in monoclinic Li3Ni2SbO6 for high voltage Li ion battery applications

单斜相Li3Ni2SbO6中的阴离子氧化还原响应及其在高电压锂离子电池中的应用

Computational Condensed Matter

IF3.9

2026-06-100

PRE

Density functional theory calculation for evaluating VSe2 as anode material for mono-valence (Li+/Na+/K+) and bi-valance (Mg+2/Ca+2/Zn+2) ion battery applications

基于密度泛函理论计算评估VSe2作为单质子(Li+/Na+/K+)和双质子(Mg+2/Ca+2/Zn+2)离子电池应用的正极材料

physica b: condensed matter

IF0

2026-01-050

PRE

Controlled single step synthesis, structural and electrode response of honeycomb layered Li3Co2SbO6

PHYSICA SCRIPTA

IF2.6

2024-09-271

PRE

Tuning of Band Gap of Cathode Li2NiPO4F by Replacing P to Nb and Forming Li2NiNbO4F for Application as 5 V Cathode in Lithium Ion Battery: A Density Functional Theory Study

JOURNAL OF THE ELECTROCHEMICAL SOCIETY

IF3.3

2024-08-080

PRE

Density functional theory analysis of Na4Mn4Ti5O18 for sodium ion battery electrode

钠离子电池电极用Na4Mn4Ti5O18的密度泛函理论分析

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2024-04-010

PRE

Density Functional Theory Study of Lithiation and Sodiation in Sb2S3 and Sb2Se3 Anode Accompanying by S/Se Redox

S/Se氧化还原伴随Sb2S3和Sb2Se3阳极中锂化和Sodiation的密度泛函理论研究

JOURNAL OF THE ELECTROCHEMICAL SOCIETY

IF3.3

2024-03-264

PRE

Prediction of feasibility of Li and Fe doped natural olivine Mg2SiO4 for Li ion battery applications using Density Functional Theory

COMPUTATIONAL CONDENSED MATTER

IF3.9

2024-03-010

PRE

Density functional theory study of SnSe2 as anode material for Mg ion battery application

SnSe2作为镁离子电池负极材料的密度泛函理论研究

COMPUTATIONAL CONDENSED MATTER

IF3.9

2023-06-012

PRE

Density functional theory study of monoclinic Li3Co2SbO6 for Li ion battery applications

MATERIALS TODAY COMMUNICATIONS

IF4.5

2023-03-014

PRE

DFT simulation of NaFeSnO4 structure, electronic and electrochemical properties validated by experimental results

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2021-05-013

PREAI

DFT study of Li2NiTiO4 and vanadium-doped Li2NiTiO4

IF2.6

2019-11-093

PREAI

DFT study of Mg2TiO4 and Ni doped Mg1.5Ni0.5TiO4 as electrode material for Mg ion battery application

JOURNAL OF MATERIALS SCIENCE

IF3.9

2017-06-1913

PREAI

Effect of Ti modification on Structural, Electronic and Electrochemical properties of Li2FeSiO4-A DFT study using FPLAPW approach

ELECTROCHIMICA ACTA

IF5.6

2017-05-0115

PREAI

Synthesis, characterization, and cell performance of Li0.5FeV1.5O4

IF2.6

2017-02-252

PREAI

Effect on de-hydrogenation efficiency on doping of rare earth elements (Pr, Nd, Gd, Dy) in MgH2 - A density functional theory study

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

IF8.3

2017-01-0121

PREAI

Effect on specific capacity and de-hydrogenation efficiency in doped-MgH2

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

IF8.3

2017-01-016

PREAI

Raman and FTIR spectroscopy study of LiFeTiO4 and Li2FeTiO4

IF2.6

2016-05-2014

PREAI

Experimental evaluation of LiFeTiO4 as an electrode

SOLID STATE IONICS

IF3.3

2014-09-017

PREAI

DFT analysis of lithium de-intercalation in Li2FeVO4

Li2FeVO4中锂脱嵌的DFT分析

IF2.6

2013-04-074

PREAI