Proposing a new model for ramp compression from ab initio calculations
ORAL
Abstract
High-pressure states of matter can be reached through static compression, using diamond
anvil cells, or by dynamic shock and ramp compression experiments. While shock
compression is relatively well understood and described by the formalism of the Hugoniot
equations, no such formalism exists for ramp compression. The compression is thought to
be quasi-isentropic, leading to lower temperatures than shock compression, but there are
currently no measurements of temperature during ramp compression or a theoretical
framework to derive how much heating occurs. In this work, we present a model of ramp
compression that is based on thermodynamics and ab initio calculations where we
approximate ramp loading as a series of compression and relaxation steps. We apply our
model to diamond and we compare our predictions with the measured stress-density
relations reported from experiments [1-3]. We find good agreement between our model and
a multishock Hugoniot scheme, as well as with a recently proposed strength model for
diamond based on plastic work [4].
References:
[1] D. Bradley et al., PRL 102, 075503 (2009).
[2] R. Smith et al., Nature 511, 330 (2014).
[3] A. Lazicki et al., Nature 589, 532 (2021).
[4] D.C. Swift et al., arXiv 2004.03071 (2020).
anvil cells, or by dynamic shock and ramp compression experiments. While shock
compression is relatively well understood and described by the formalism of the Hugoniot
equations, no such formalism exists for ramp compression. The compression is thought to
be quasi-isentropic, leading to lower temperatures than shock compression, but there are
currently no measurements of temperature during ramp compression or a theoretical
framework to derive how much heating occurs. In this work, we present a model of ramp
compression that is based on thermodynamics and ab initio calculations where we
approximate ramp loading as a series of compression and relaxation steps. We apply our
model to diamond and we compare our predictions with the measured stress-density
relations reported from experiments [1-3]. We find good agreement between our model and
a multishock Hugoniot scheme, as well as with a recently proposed strength model for
diamond based on plastic work [4].
References:
[1] D. Bradley et al., PRL 102, 075503 (2009).
[2] R. Smith et al., Nature 511, 330 (2014).
[3] A. Lazicki et al., Nature 589, 532 (2021).
[4] D.C. Swift et al., arXiv 2004.03071 (2020).
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Publication: "Model of Ramp Compression of Diamond from Ab Initio Simulations," F. González-Cataldo, B.K. Godwal, Kevin Driver, Raymond Jeanloz, and Burkhard Militzer. Physical Review B, 104, 134104 (2021)
Presenters
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Felipe J Gonzalez
University of California, Berkeley
Authors
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Felipe J Gonzalez
University of California, Berkeley
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Budhiram K Godwal
University of California, Berkeley
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Kevin P Driver
Lawrence Livermore Natl Lab
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Raymond Jeanloz
University of California, Berkeley
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Burkhard Militzer
University of California, Berkeley