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Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures

We present structure and equation of state (EOS) measurements of biaxially orientated polyethylene terephthalate (PET, [Formula: see text] , also called mylar) shock-compressed to ([Formula: see text] ) GPa and ([Formula: see text] ) K using in situ X-ray diffraction, Doppler velocimetry, and optica...

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Autores principales: Lütgert, J., Vorberger, J., Hartley, N. J., Voigt, K., Rödel, M., Schuster, A. K., Benuzzi-Mounaix, A., Brown, S., Cowan, T. E., Cunningham, E., Döppner, T., Falcone, R. W., Fletcher, L. B., Galtier, E., Glenzer, S. H., Laso Garcia, A., Gericke, D. O., Heimann, P. A., Lee, H. J., McBride, E. E., Pelka, A., Prencipe, I., Saunders, A. M., Schölmerich, M., Schörner, M., Sun, P., Vinci, T., Ravasio, A., Kraus, D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8213800/
https://www.ncbi.nlm.nih.gov/pubmed/34145307
http://dx.doi.org/10.1038/s41598-021-91769-0
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author Lütgert, J.
Vorberger, J.
Hartley, N. J.
Voigt, K.
Rödel, M.
Schuster, A. K.
Benuzzi-Mounaix, A.
Brown, S.
Cowan, T. E.
Cunningham, E.
Döppner, T.
Falcone, R. W.
Fletcher, L. B.
Galtier, E.
Glenzer, S. H.
Laso Garcia, A.
Gericke, D. O.
Heimann, P. A.
Lee, H. J.
McBride, E. E.
Pelka, A.
Prencipe, I.
Saunders, A. M.
Schölmerich, M.
Schörner, M.
Sun, P.
Vinci, T.
Ravasio, A.
Kraus, D.
author_facet Lütgert, J.
Vorberger, J.
Hartley, N. J.
Voigt, K.
Rödel, M.
Schuster, A. K.
Benuzzi-Mounaix, A.
Brown, S.
Cowan, T. E.
Cunningham, E.
Döppner, T.
Falcone, R. W.
Fletcher, L. B.
Galtier, E.
Glenzer, S. H.
Laso Garcia, A.
Gericke, D. O.
Heimann, P. A.
Lee, H. J.
McBride, E. E.
Pelka, A.
Prencipe, I.
Saunders, A. M.
Schölmerich, M.
Schörner, M.
Sun, P.
Vinci, T.
Ravasio, A.
Kraus, D.
author_sort Lütgert, J.
collection PubMed
description We present structure and equation of state (EOS) measurements of biaxially orientated polyethylene terephthalate (PET, [Formula: see text] , also called mylar) shock-compressed to ([Formula: see text] ) GPa and ([Formula: see text] ) K using in situ X-ray diffraction, Doppler velocimetry, and optical pyrometry. Comparing to density functional theory molecular dynamics (DFT-MD) simulations, we find a highly correlated liquid at conditions differing from predictions by some equations of state tables, which underlines the influence of complex chemical interactions in this regime. EOS calculations from ab initio DFT-MD simulations and shock Hugoniot measurements of density, pressure and temperature confirm the discrepancy to these tables and present an experimentally benchmarked correction to the description of PET as an exemplary material to represent the mixture of light elements at planetary interior conditions.
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spelling pubmed-82138002021-06-22 Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures Lütgert, J. Vorberger, J. Hartley, N. J. Voigt, K. Rödel, M. Schuster, A. K. Benuzzi-Mounaix, A. Brown, S. Cowan, T. E. Cunningham, E. Döppner, T. Falcone, R. W. Fletcher, L. B. Galtier, E. Glenzer, S. H. Laso Garcia, A. Gericke, D. O. Heimann, P. A. Lee, H. J. McBride, E. E. Pelka, A. Prencipe, I. Saunders, A. M. Schölmerich, M. Schörner, M. Sun, P. Vinci, T. Ravasio, A. Kraus, D. Sci Rep Article We present structure and equation of state (EOS) measurements of biaxially orientated polyethylene terephthalate (PET, [Formula: see text] , also called mylar) shock-compressed to ([Formula: see text] ) GPa and ([Formula: see text] ) K using in situ X-ray diffraction, Doppler velocimetry, and optical pyrometry. Comparing to density functional theory molecular dynamics (DFT-MD) simulations, we find a highly correlated liquid at conditions differing from predictions by some equations of state tables, which underlines the influence of complex chemical interactions in this regime. EOS calculations from ab initio DFT-MD simulations and shock Hugoniot measurements of density, pressure and temperature confirm the discrepancy to these tables and present an experimentally benchmarked correction to the description of PET as an exemplary material to represent the mixture of light elements at planetary interior conditions. Nature Publishing Group UK 2021-06-18 /pmc/articles/PMC8213800/ /pubmed/34145307 http://dx.doi.org/10.1038/s41598-021-91769-0 Text en © The Author(s) 2021 https://creativecommons.org/licenses/by/4.0/Open AccessThis article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Lütgert, J.
Vorberger, J.
Hartley, N. J.
Voigt, K.
Rödel, M.
Schuster, A. K.
Benuzzi-Mounaix, A.
Brown, S.
Cowan, T. E.
Cunningham, E.
Döppner, T.
Falcone, R. W.
Fletcher, L. B.
Galtier, E.
Glenzer, S. H.
Laso Garcia, A.
Gericke, D. O.
Heimann, P. A.
Lee, H. J.
McBride, E. E.
Pelka, A.
Prencipe, I.
Saunders, A. M.
Schölmerich, M.
Schörner, M.
Sun, P.
Vinci, T.
Ravasio, A.
Kraus, D.
Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title_full Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title_fullStr Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title_full_unstemmed Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title_short Measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
title_sort measuring the structure and equation of state of polyethylene terephthalate at megabar pressures
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8213800/
https://www.ncbi.nlm.nih.gov/pubmed/34145307
http://dx.doi.org/10.1038/s41598-021-91769-0
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