Fig.1: Cumulative electricity requirement for the European fleet between 2018 and 2100
Fig.1: Cumulative electricity requirement for the European fleet between 2018 and 2100.

“JF” = fossil kerosene scenario. “syn-JF” = synthetic kerosene scenario (100% by 2063). “Flight-CO2 neutral” = only warming from kerosene combustion is mitigated. “Warming-neutral” = the warming caused by the fleet is stabilized from 2050 on. “Climate-neutral” = the warming impact between 2018 and 2100 is entirely mitigated. “DACCS” = Direct Air Capture with Carbon Storage.
A snapshot from MD simulation of Na-montmorillonite, at variable interlayer nanopore distances. Oxygen atoms are red. Hydrogen atoms are white. Silica atoms are yellow. Aluminium atoms are green. Magnesium atoms are black. Sodium atoms are blue. Carbon atom of Methane is pink and Hydrogen atom of Methane are light green.

A snapshot from MD simulation of Na-montmorillonite, at variable interlayer nanopore distances. Oxygen atoms are red. Hydrogen atoms are white. Silica atoms are yellow. Aluminium atoms are green. Magnesium atoms are black. Sodium atoms are blue. Carbon atom of Methane is pink and Hydrogen atom of Methane are light green
31.03.2023

Mobility of Dissolved Gases in Smectite under Saturated Conditions

Mobility of water, sodium and gas molecules within a smectite nanopore

Various gases are produced by metal corrosion and organic material degradation in deep gelological repository for nuclear waste. To ensure repository safety, it's important to demonstrate that gases can be dissipated by diffusion in host rocks and prevent pressure buildup in repository near field. Smectite mineral particles form a pore network that is usually saturated with water, making gas diffusion the primary transport mechanism. Molecular simulations have shown that the diffusion of gases through the pore network depends on various factors, including pore size and temperature. For instance, smaller pores and lower temperatures tend to reduce gas diffusion. Interestingly, hydrogen and helium have been found to diffuse faster than argon, carbon dioxide, and methane, possibly due to interactions with the clay surface and water molecules. Ultimately, the diffusion coefficients for different gases and pore sizes can be predicted using an empirical relationship, which is useful for macroscopic simulations of gas transport.

A snapshot from MD simulation of Na-montmorillonite, at variable interlayer nanopore distances. Oxygen atoms are red. Hydrogen atoms are white. Silica atoms are yellow. Aluminium atoms are green. Magnesium atoms are black. Sodium atoms are blue. Carbon atom of Methane is pink and Hydrogen atom of Methane are light green.

A snapshot from MD simulation of Na-montmorillonite, at variable interlayer nanopore distances. Oxygen atoms are red. Hydrogen atoms are white. Silica atoms are yellow. Aluminium atoms are green. Magnesium atoms are black. Sodium atoms are blue. Carbon atom of Methane is pink and Hydrogen atom of Methane are light green

PSI Center for Nuclear Engineering and Sciences

Safety of currently operating light-water reactors, safety characteristics of future reactor concepts, and long-term safety of deep geological repositories for nuclear wastes are the main research topics at the PSI Center for Nuclear Engineering and Sciences.

Highlight DIRK 02/2023 teaser

Approximate Computing for Nuclear Reactor Simulations

During the last decades, computing power has been subject to tremendous progress due to the shrinking of transistor size as predicted by Moore’s law. However, as we approach the physical limits of this scaling, alternative techniques have to be deployed to increase computing performance. In this regard, the next big advance is envisioned to be the usage of approximate computing hardware based on field-programmable gate arrays and/or digital-analogue in-memory circuits. Such approximate computing can provide disproportional gain (x1000) in energy efficiency and/or execution time for acceptable loss of simulation accuracy. This could be highly beneficial in order to accelerate computational intensive simulations such as reactor core analyses with higher resolution multi-physics models. On the other hand, the execution of programming codes on low-precision hardware may result in inadequate outcomes due to quality degradation and/or algorithm divergence. To address these questions, studies on the stability and the performance of advanced reactor simulation algorithms as function of reduced floating-point arithmetic precision are being conducted at the laboratory for reactor physics and thermal-hydraulics. Results obtained so far indicate a large room for the acceleration of nuclear engineering applications using mixed-precision hardware. Therefore, research is now being enlarged towards assessing multiprecision computing methods for reactor core simulations with higher spatial resolution.

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