Simulations of electrode & solid electrolyte materials

Niek de Klerk

doi:10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78

Simulations of electrode & solid electrolyte materials

Niek de Klerk

RST/Storage of Electrochemical Energy

Research output: Thesis › Dissertation (TU Delft)

438 Downloads (Pure)

Abstract

Batteries have found widespread use, especially in mobile devices. With the inevitable energy transition the demand for batteries will rise further. Batteries for large-scale storage, transport applications and mobile devices all have different demands, requiring the development of a range of battery types for the storage of electrical energy. For these developments a better understanding of the fundamental aspects of materials and energy is necessary.

Original language	English
Qualification	Doctor of Philosophy
Awarding Institution	Delft University of Technology
Supervisors/Advisors	Wagemaker, M., Supervisor Brück, E.H., Supervisor
Thesis sponsors	A green Deal in Energy Materials (ADEM) of the Ministry of Economic Affairs of The Netherlands
Award date	31 Jan 2019
DOIs	https://doi.org/10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78
Publication status	Published - 2019

Keywords

Batteries
Solid Electrolytes
Space-charge Layers
Molecular Dynamics Simulations
Phase-field Modelling

UN SDGs

This output contributes to the following UN Sustainable Development Goals (SDGs)

Access to Document

10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78

DissertationFinal published version, 11.5 MBLicence: CC BY-SA

5 Article

Analysis of Diffusion in Solid-State Electrolytes through MD Simulations, Improvement of the Li-Ion Conductivity in β‑Li3PS4 asan Example
de Klerk, N., van der Maas, E. & Wagemaker, M., 2018, In: ACS Applied Energy Materials. 1, 7, p. 3230-3242
Research output: Contribution to journal › Article › Scientific › peer-review

Open Access
File
122 Citations (Scopus)

89 Downloads (Pure)
Space-Charge Layers in All-Solid-State Batteries; Important or Negligible?
de Klerk, N. & Wagemaker, M., 2018, In: ACS Applied Energy Materials. 1, 1, p. 5609-5618
Research output: Contribution to journal › Article › Scientific › peer-review

Open Access
File

124 Citations (Scopus)

210 Downloads (Pure)
Explaining key properties of lithiation in TiO2-anatase Li-ion battery electrodes using phase-field modeling
de Klerk, N., Vasileiadis, A., Smith, R. B., Bazant, M. Z. & Wagemaker, M., 2017, In: Physical Review Materials. 1, 2, 13 p., 025404.
Research output: Contribution to journal › Article › Scientific › peer-review

Open Access
File
35 Citations (Scopus)

130 Downloads (Pure)

Cite this

@phdthesis{48e17e42533541b3838a0586523e5b78,

title = "Simulations of electrode & solid electrolyte materials",

abstract = "Batteries have found widespread use, especially in mobile devices. With the inevitable energy transition the demand for batteries will rise further. Batteries for large-scale storage, transport applications and mobile devices all have different demands, requiring the development of a range of battery types for the storage of electrical energy. For these developments a better understanding of the fundamental aspects of materials and energy is necessary.",

keywords = "Batteries, Solid Electrolytes, Space-charge Layers, Molecular Dynamics Simulations, Phase-field Modelling",

author = "{de Klerk}, Niek",

year = "2019",

doi = "10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78",

language = "English",

type = "Dissertation (TU Delft)",

school = "Delft University of Technology",

}

TY - THES

T1 - Simulations of electrode & solid electrolyte materials

AU - de Klerk, Niek

PY - 2019

Y1 - 2019

N2 - Batteries have found widespread use, especially in mobile devices. With the inevitable energy transition the demand for batteries will rise further. Batteries for large-scale storage, transport applications and mobile devices all have different demands, requiring the development of a range of battery types for the storage of electrical energy. For these developments a better understanding of the fundamental aspects of materials and energy is necessary.

AB - Batteries have found widespread use, especially in mobile devices. With the inevitable energy transition the demand for batteries will rise further. Batteries for large-scale storage, transport applications and mobile devices all have different demands, requiring the development of a range of battery types for the storage of electrical energy. For these developments a better understanding of the fundamental aspects of materials and energy is necessary.

KW - Batteries

KW - Solid Electrolytes

KW - Space-charge Layers

KW - Molecular Dynamics Simulations

KW - Phase-field Modelling

U2 - 10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78

DO - 10.4233/uuid:48e17e42-5335-41b3-838a-0586523e5b78

M3 - Dissertation (TU Delft)

ER -

Simulations of electrode & solid electrolyte materials

Abstract

Keywords

UN SDGs

Access to Document

Fingerprint

Research output

Analysis of Diffusion in Solid-State Electrolytes through MD Simulations, Improvement of the Li-Ion Conductivity in β‑Li3PS4 asan Example

Space-Charge Layers in All-Solid-State Batteries; Important or Negligible?

Explaining key properties of lithiation in TiO2-anatase Li-ion battery electrodes using phase-field modeling

Cite this