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624 result(s) for "Helium diffusion"
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Distributions and accumulation mechanisms of helium in petroliferous basins
Helium is an irreplaceable strategic mineral resource, and commercial helium-rich gas fields (He>0.1%) worldwide are typically discovered serendipitously during hydrocarbon exploration efforts. According to an analysis of 75 helium-rich gas fields and 1048 natural gas samples worldwide, helium in natural gas generally exhibits “scarce”, “accompanying”, and “complex” properties, and helium-rich gas fields often occur at depths <4500 m. Helium concentrations in He-CH 4 and He-CO 2 gas fields are notably lower than those in He-N 2 gas fields (He>1%). However, geological reserves in the former two types of gas fields are mainly in the range of 10 7 –10 11 m 3 , whereas in the latter, they are only in the range of 10 5 –10 7 m 3 . There are nevertheless notable disparities in the genesis and migration patterns between helium and gaseous hydrocarbons. Helium necessitates carriers (such as formation water, hydrocarbon fluids, N 2 , mantle-derived fluids, etc.) during both accumulation and long-distance migration processes, where migration conduits are not confined to sedimentary strata, and may extend to the basin’s basement, lower crust, and even lithospheric mantle. However, the accumulation conditions of both helium and gaseous hydrocarbons are generally considered equivalent. The presence of gaseous hydrocarbons facilitates both the rapid exsolution of helium within helium-containing fluids and subsequent efficient aggregation in gaseous hydrocarbons, while both reduce helium diffusion and diminish escape flux. In terms of caprock, gypsum, salt, and thick shale as sealing layers contribute to the long-term preservation of helium over geological timescales. Large helium-rich gas fields, predominantly crust-derived gas fields, are primarily concentrated in uplifted zones of ancient cratonic basins and their peripheries. Based on a diagram of the He concentration versus He/N 2 ratio, crust-derived helium fields can be categorized as basement, combined basement-sedimentary rock, and sedimentary rock helium supply types. Comprehensively given China’s helium grade, helium resource endowment, natural gas industrialization process, and current helium purification processes, the foremost deployment zones for the commercial production of helium should be the helium-rich gas fields located in the Ordos, Tarim, Sichuan, and Qaidam Basins in western and central China. In addition, certain (extra) large helium-containing gas fields serve as important replacement zones.
Molecular dynamics simulations of helium transport through inorganic mineral nanopores
Helium transport through nanoscale inorganic mineral pores and pore throats is essential for its overall migration. To elucidate helium’s transport dynamics within nanopores, we employed equilibrium and non-equilibrium molecular dynamics simulations to investigate helium’s static self-diffusion and pressure-driven flow in quartz slit-shaped nanopores. We also introduced water and various gases, including hydrogen, methane, ethane, nitrogen, and carbon dioxide, into the nanopores to assess their influence on helium transport. Our findings indicate minimal helium adsorption on quartz pore surfaces. Under conditions where the pore size is less than 5 nm and the pressure under 10 MPa, environmental factors markedly influence helium diffusion. Large pore sizes, high temperatures, and low gas pressures enhance helium desorption and facilitate faster diffusion. We observed a positive correlation between helium flow velocity and factors such as pore size, pressure gradient, and surface smoothness of the pores. Notably, the presence of pore water and carrier gases in quartz nanopores, which diffuse more slowly than helium, tends to reduce helium surface adsorption and slow its diffusion. Among the carrier gases studied, nitrogen showed similar adsorption capacity, diffusivity, and stability to helium, while carbon dioxide displayed the highest adsorption capacity and the slowest diffusion rate, markedly differing from helium. Based on the simulation results, we concluded that water and carrier gases primarily function as transport mediums in helium migration, moving together with helium. Nitrogen, which shares similar properties with helium, effectively assists in this co-migration process. Conversely, carbon dioxide, due to its high adsorption capacity and slow diffusion, tends to be lost during co-migration. As a result, gas reservoirs with high nitrogen levels and low carbon dioxide levels are more likely to have higher helium concentrations. Additionally, the smaller pore sizes and higher gas pressures in caprocks can impede helium’s diffusion, favoring its preservation in reservoirs. Moreover, the presence of water and carrier gases significantly obstructs these pores, further hindering helium’s escape.
Radiation damage effects on helium diffusion in zircon
We report the effects of radiation damage on helium diffusion in zircon using data from molecular dynamics simulations. We observe an increase in activation energy for helium diffusion as a result of radiation damage and increasing structural disorder. The activation energy in a heavily damaged region is smaller than in a completely amorphous system which is correlated with remaining order in the cation sublattices of the damaged structure not present in the fully amorphized system. The increase in activation energy is related to the disappearance of fast diffusion pathways that are present in the crystal. Consistent with the change in activation energy, we observe the accumulation of helium atoms in the damaged structure and discuss the implications of this effect for the formation of helium bubbles and zircon’s performance as an encapsulation material for nuclear waste. Graphic abstract
Helium diffusion as sine-Gordon kink in disordered quartz structure
Discrete model (local chains approach) reveals the influence of heterogeneity of structure on the movement of a helium atom in the form of a soliton Frenkel-Kontorova. The transition to the field form of this equation - to the Klein-Fock-Gordon equation or, simply, to the sine-Gordon equation, allows us to calculate the diffusion coefficient of such a soliton, taking into account the collective nature of the movement of the atom and the accompanying reversible displacements of the atoms of the environment through the medium in the form of a soliton and taking into account the details of the structure of nanostructures.
Investigating Helium-Induced Thermal Conductivity Degradation in Fusion-Relevant Copper: A Molecular Dynamics Approach
Copper alloys are critical heat sink materials for fusion reactor divertors due to their high thermal conductivity (TC) and strength, yet their performance under extreme particle bombardment and heat fluxes in future tokamaks requires enhancement. While neutron-induced transmutation helium affects the properties of copper, the atomistic mechanisms linking helium bubble size to thermal transport remain unclear. This study employs non-equilibrium molecular dynamics (NEMD) simulations to isolate the effect of bubble diameter (10, 20, 30, 40 Å) on TC in copper, maintaining a constant He-to-vacancy ratio of 2.5. Results demonstrate that larger bubbles significantly impair TC. This reduction correlates with increased Kapitza thermal resistance and pronounced lattice distortion from outward helium diffusion, intensifying phonon scattering. Phonon density of states (PDOS) analysis reveals diminished low-frequency peaks and an elevated high-frequency peak for bubbles >30 Å, confirming phonon confinement and localized vibrational modes. The PDOS overlap factor decreases with bubble size, directly linking microstructural evolution to thermal resistance. These findings elucidate the size-dependent mechanisms of helium bubble impacts on thermal transport in copper divertor materials.
Nucleation of Helium in Liquid Lithium at 843 K and High Pressures
Fusion energy stands out as a promising alternative for a future decarbonised energy system. In order to be sustainable, future fusion nuclear reactors will have to produce their own tritium. In the so-called breeding blanket of a reactor, the neutron bombardment of lithium will produce the desired tritium, but also helium, which can trigger nucleation mechanisms owing to the very low solubility of helium in liquid metals. An understanding of the underlying microscopic processes is important for improving the efficiency, sustainability and reliability of the fusion energy conversion process. The spontaneous creation of helium droplets or bubbles in the liquid metal used as breeding material in some designs may be a serious issue for the performance of the breeding blankets. This phenomenon has yet to be fully studied and understood. This work aims to provide some insight on the behaviour of lithium and helium mixtures at experimentally corresponding operating conditions (843 K and pressures between 108 and 1010 Pa). We report a microscopic study of the thermodynamic, structural and dynamical properties of lithium–helium mixtures, as a first step to the simulation of the environment in a nuclear fusion power plant. We introduce a new microscopic model devised to describe the formation of helium droplets in the thermodynamic range considered. Our model predicts the formation of helium droplets at pressures around 109 Pa, with radii between 1 and 2 Å. The diffusion coefficient of lithium (2 Å2/ps) is in excellent agreement with reference experimental data, whereas the diffusion coefficient of helium is in the range of 1 Å2/ps and tends to decrease as pressure increases.
Implications of Microstructure in Helium-Implanted Nanocrystalline Metals
Helium bubbles are known to form in nuclear reactor structural components when displacement damage occurs in conjunction with helium exposure and/or transmutation. If left unchecked, bubble production can cause swelling, blistering, and embrittlement, all of which substantially degrade materials and—moreover—diminish mechanical properties. On the mission to produce more robust materials, nanocrystalline (NC) metals show great potential and are postulated to exhibit superior radiation resistance due to their high defect and particle sink densities; however, much is still unknown about the mechanisms of defect evolution in these systems under extreme conditions. Here, the performances of NC nickel (Ni) and iron (Fe) are investigated under helium bombardment via transmission electron microscopy (TEM). Bubble density statistics are measured as a function of grain size in specimens implanted under similar conditions. While the overall trends revealed an increase in bubble density up to saturation in both samples, bubble density in Fe was over 300% greater than in Ni. To interrogate the kinetics of helium diffusion and trapping, a rate theory model is developed that substantiates that helium is more readily captured within grains in helium-vacancy complexes in NC Fe, whereas helium is more prone to traversing the grain matrices and migrating to GBs in NC Ni. Our results suggest that (1) grain boundaries can affect bubble swelling in grain matrices significantly and can have a dominant effect over crystal structure, and (2) an NC-Ni-based material can yield superior resistance to irradiation-induced bubble growth compared to an NC-Fe-based material and exhibits high potential for use in extreme environments where swelling due to He bubble formation is of significant concern.
Swelling and Helium Bubble Morphology in a Cryogenically Treated FeCrNi Alloy with Martensitic Transformation and Reversion after Helium Implantation
A cryo-quenched 70 wt % Fe-15 wt% Cr-15 wt% Ni single-crystal alloy with fcc (face centered cubic), bcc (body centered cubic), and hcp (hexagonal close packed) phases was implanted with 200 keV He+ ions up to 2 × 1017 ions·cm−2 at 773 K. Surface-relief features were observed subsequent to the He+ ion implantation, and transmission electron microscopy was used to characterize both the surface relief properties and the details of associated “swelling effects” arising cumulatively from the austenitic-to-martensitic phase transformation and helium ion-induced bubble evolution in the single-crystal ternary alloy. The bubble size in the bcc phase was found to be larger than that in the fcc phase, while the bubble density in the bcc phase was correspondingly lower. The phase boundaries with misfit dislocations formed during the martensitic transformation and reversion processes served as helium traps that dispersed the helium bubble distribution. Swelling caused by the phase transformation in the alloy was dominant compared to that caused by helium bubble formation due to the limited depth of the helium ion implantation. The detailed morphology of helium bubbles formed in the bcc, hcp, and fcc phases were compared and correlated with the characters of each phase. The helium diffusion coefficient under irradiation at 773 K in the bcc phase was much higher (i.e., by several orders of magnitude) than that in the fcc phase and led to faster bubble growth. Moreover, the misfit phase boundaries were shown to be effective sites for the diffusion of helium atoms. This feature may be considered to be a desirable property for improving the radiation tolerance of the subject, ternary alloy.
Effect of helium on structure and compression behavior of SiO₂ glass
The behavior of volatiles is crucial for understanding the evolution of the Earth's interior, hydrosphere, and atmosphere. Noble gases as neutral species can serve as probes and be used for examining gas solubility in silicate melts and structural responses to any gas inclusion. Here, we report experimental results that reveal a strong effect of helium on the intermediate range structural order of SiO₂ glass and an unusually rigid behavior of the glass. The structure factor data show that the first sharp diffraction peak position of SiO₂ glass in helium medium remains essentially the same under pressures up to 18.6 GPa, suggesting that helium may have entered in the voids in SiO₂ glass under pressure. The dissolved helium makes the SiO₂ glass much less compressible at high pressures. GeO₂ glass and SiO₂ glass with H₂ as pressure medium do not display this effect. These observations suggest that the effect of helium on the structure and compression of SiO₂ glass is unique.
Anomalous Diffusion of Helium and Neon in Low-Density Silica Glass
The diffusion properties of low-density non-porous silica glasses (expanded silica glasses) were researched with the aim of searching for the molecular structure of membrane materials intended for the effective separation of helium–neon gas mixtures. It has been shown on a large number (84) of computer models of such glasses that there are molecular structures of silica in which various helium and neon diffusion mechanisms are simultaneously implemented: superdiffusion for helium and subdiffusion for neon. This makes it possible to significantly (by 3–5 orders of magnitude) increase the helium permeability of such glasses at room temperature and maintain a high selectivity for the separation of helium and neon (at the level of 104–105) at the same time.