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I dont actually have any error but i just want to understand something. When i was following the minimal examples, i have to run MD simulation( i was running 10000 steps) before a parse the vasprun.x…
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Hi @yury-lysogorskiy
I am currently exploring to use the PACE framework to predict the thermal conductivity of AlGaN alloys using the Green-Kubo method (by performing equilibrium molecular dynamic…
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**Is your feature request related to a problem? Please describe.**
We are working on an engineering approach to modeling thermal runaway in batteries. I am working on a proof-of-concept model in FDS …
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Right now... materials aren't as thermally dependent as they need to be. At the moment, only density can be dependent on temperature. Repeat that model for thermal conductivity.
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Issue overview
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In the attached example files, there is a simple shoebox building with a single conditioned zone and an unconditioned ceiling space above it. In the first example file,…
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Calculating the lattice thermal conductivity based on the Boltzmann transport equation (BTE) and lattice dynamics (harmonic and anharmonic).
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spotted by @ikorotkin
The BPX schema includes a field `["Parameterisation"]["Cell"]["Thermal conductivity [W.m-1.K-1]"]`. However, this parameter is not defined or used in the corresponding mathem…
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Hi,
After femtosecond laser excitation of metals is it assumed that the electronic thermal conductivity (k_el) varies in the way:
k_el = k_0*(Te/Ti),
where k_0 - is the initial electronic thermal…
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Some applications may require an anisotropic diffusion coefficient.
It may be worth trying to implement that in FESTIM.
Some useful links:
- https://fenicsproject.discourse.group/t/anisotropic-…
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I have successfully calculated the viscosity of the mixture but I am having difficulty in calculating the thermal conductivity of the mixture, is there any other operation required apart from the four…