Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Marcin Minkowski; Kerstin Hummer; Christoph Dellago

doi:10.1088/1361-648X/abb740

Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Marcin Minkowski (Corresponding author), Kerstin Hummer, Christoph Dellago

Publications: Contribution to journal › Article › Peer Reviewed

Original language	English
Article number	015901
Number of pages	11
Journal	Journal of Physics: Condensed Matter
Volume	33
Issue number	1
DOIs	https://doi.org/10.1088/1361-648X/abb740
Publication status	Published - 6 Jan 2021

Austrian Fields of Science 2012

103015 Condensed matter

Keywords

molecular dynamics
diffusion
machine learning
CDTE
Machine learning
Molecular dynamics
Diffusion

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10.1088/1361-648X/abb740Licence: CC BY 4.0

https://arxiv.org/abs/2007.08975Licence: Unspecified

Cite this

@article{7257c3c86b9b419396c1085e8a13713f,

title = "Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations",

keywords = "molecular dynamics, diffusion, machine learning, CDTE, Machine learning, Molecular dynamics, Diffusion",

author = "Marcin Minkowski and Kerstin Hummer and Christoph Dellago",

note = "Publisher Copyright: {\textcopyright} 2020 The Author(s). Published by IOP Publishing Ltd",

year = "2021",

month = jan,

day = "6",

doi = "10.1088/1361-648X/abb740",

language = "English",

volume = "33",

journal = "Journal of Physics: Condensed Matter",

issn = "0953-8984",

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Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations. / Minkowski, Marcin (Corresponding author); Hummer, Kerstin ; Dellago, Christoph.
In: Journal of Physics: Condensed Matter, Vol. 33, No. 1, 015901, 06.01.2021.

Publications: Contribution to journal › Article › Peer Reviewed

TY - JOUR

T1 - Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

AU - Minkowski, Marcin

AU - Hummer, Kerstin

AU - Dellago, Christoph

PY - 2021/1/6

Y1 - 2021/1/6

KW - molecular dynamics

KW - diffusion

KW - machine learning

KW - CDTE

KW - Machine learning

KW - Molecular dynamics

KW - Diffusion

UR - http://www.scopus.com/inward/record.url?scp=85092944369&partnerID=8YFLogxK

U2 - 10.1088/1361-648X/abb740

DO - 10.1088/1361-648X/abb740

M3 - Article

SN - 0953-8984

VL - 33

JO - Journal of Physics: Condensed Matter

JF - Journal of Physics: Condensed Matter

IS - 1

M1 - 015901

ER -

Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Austrian Fields of Science 2012

Keywords

Access to Document

Other files and links

Transition Path Sampling of Exchange Processes in Solids

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Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Austrian Fields of Science 2012

Keywords

Access to Document

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Projects

Transition Path Sampling of Exchange Processes in Solids

Cite this