The Role of Sulphur in Space Chemistry
This research sheds light on sulphur's interactions within dust grains in space.
― 7 min read
Table of Contents
Sulphur is an important element for life on Earth. It plays a key role in many biological processes and is found in proteins and vitamins. However, before life existed, sulphur had noteworthy chemical interactions in space, particularly in the areas where stars and planets are formed. Understanding how sulphur behaves in the interstellar medium (ISM) is essential for astronomers and chemists alike.
In space, sulphur is the tenth most common element, and its abundance is used as a reference point for studying its presence in different environments. In some areas, like diffuse clouds, sulphur is mostly found in gas form, but in denser regions, like Molecular Clouds, its form is not so clear. Scientists believe that atomic sulphur is the main form in these younger areas, but it gradually gets depleted over time. One reason for this depletion could be the process of Freeze-out, where gas-phase sulphur sticks to Dust Grains, which are tiny particles floating in space.
Dust grains consist of small rock-like materials known as silicates and carbon compounds. These grains provide surfaces where different chemical reactions can take place. Although some sulphur compounds have been detected on dust surfaces, many others have not. Therefore, researchers aim to study how sulphur-containing molecules interact with these dust grains before they become depleted.
In particular, the study highlights olivine, which is one of the most common minerals in space and can have different compositions. By using advanced calculations, scientists can explore how different sulphur-bearing molecules stick to olivine grains. They have found that the interaction between these molecules and the grain surfaces varies based on the type of sulphur compound and its charge.
Importance of Sulphur in Life and Space
Sulphur is essential for many biological processes, and it was likely important long before life emerged on Earth. In the ISM, sulphur’s chemistry is challenging to understand, but it is crucial for studying how stars and planets form.
Knowing the abundance of sulphur in the universe helps researchers understand its role in the evolution of planetary systems. In diffuse clouds, the majority of sulphur exists in gas form, but researchers are still trying to figure out what forms it takes in denser regions. Atomic sulphur appears to be the primary type in young stellar areas, but as time passes, it becomes less visible.
The freeze-out process in molecular clouds involves the adsorption of gas-phase sulphur onto the surfaces of icy grains. Researchers expected to find certain sulphur compounds there, but only some have been detected. Instead, studies have suggested that sulphur may mostly be found in organic compounds or in complex forms that have undergone changes due to ice processing.
Comets and specific meteorites have shown the presence of sulphur, providing a snapshot of the chemical makeup of the early solar system. For instance, chondrites, a type of meteorite, show sulphur mainly in the form of minerals, while others contain sulphides. These findings provide clues to how sulphur has been preserved over billions of years in space.
Investigating Dust Grains and Sulphur Interactions
To understand what happens to sulphur in diffuse clouds, researchers investigate how simple sulphur species interact with dust grains. These grains contain atoms necessary for creating the sulphides found in more advanced areas. Dust grains are formed primarily from silicates and carbonaceous materials and are a significant part of the mass in the ISM.
Olivine is a mineral that provides a good model for dust grain cores in these studies. There are different types of olivine, and the research examines how sulphur-bearing species, both neutral and charged, interact with these grains. Advanced computational methods allow scientists to simulate these interactions and reveal important insights.
Various sulphur species, such as HS and CS, are explored in different settings. Researchers pay close attention to the binding energy, which shows how strongly a molecule is held to the surface of a grain. Stronger interactions imply a higher chance for these molecules to stick around in space, contributing to sulphur depletion.
Researchers have found that some sulphur-bearing molecules prefer to interact with iron (Fe) centers in grains rather than with magnesium (Mg) centers. This preference can significantly affect how sulphur behaves in different environments. The findings also suggest that the binding energies of sulphur species differ based on their charge, which affects their interactions with grain surfaces.
Methods and Modeling Techniques
The study employs a combination of computational methods to model the interactions of sulphur-bearing molecules with olivine grains. These methods help researchers visualize the energy and stability of different adsorption complexes formed during interactions.
First, researchers optimize the structures of olivine clusters using various computational techniques. This step involves understanding the best way to represent these clusters for accurate results. Using different methodologies, the researchers analyze how sulphur-bearing molecules interact with these grain models.
To further understand how these interactions work, scientists look at the configurations of clusters and the stability of different spin states. Through complex calculations, they can derive values for binding energies that indicate how strongly the sulphur species adhere to the surface of the grains.
An additional important aspect of the study is the understanding of dissociation processes that occur when sulphur species bind to grain surfaces. Some models show that certain sulphur compounds can spontaneously break apart when they interact with olivine, which also influences how they behave in space.
The research also compares the performance of different computational methods to ensure that the findings are reliable. By analyzing the energies of various species interacting with olivine models, researchers gain a clearer picture of how these interactions might occur in real environments.
Results and Observations
The results indicate that different sulphur-bearing species interact with dust grains in varied ways. Binding energies calculated during the study reveal that sulphur compounds tend to stick to the mineral cores of dust grains much more effectively than to icy surfaces.
Specific findings show that the interactions between sulphur species and iron centers are stronger than those with magnesium centers. This observation points to the potential role that these metal centers play in forming stronger connections with sulphur molecules.
Furthermore, bound sulphur species are more likely to remain trapped on grain surfaces, even in the low temperatures typically found in diffuse clouds. This possibility suggests that sulphur could build up in these locations without easily returning to the gas phase.
The interactions between charged sulphur species and the negatively charged grain surfaces further reveal a higher likelihood of adsorption. When these charged exchanges occur, they can lead to significant changes in the binding energy and the reactivity of these sulphur compounds.
Implications of Findings
The research has important implications for understanding sulphur chemistry in space. The findings suggest that sulphur species can become part of the core of dust grains, impacting how they exist in dense regions of the ISM. This can help explain the observed depletion of sulphur in various environments.
One key aspect of the work highlights the potential for sulphur compounds to form lasting bonds within the grain core. This process suggests that sulphur species may not only be transient visitors in the gas phase but could play critical roles in the formation of new materials within the cores of these dust grains.
The results also challenge previous assumptions that sulphur interactions in warmer environments are negligible. Instead, the strong binding energies observed suggest that these interactions should be taken into account even at higher temperatures.
Conclusion
The study of sulphur interactions with dust grains provides vital insights into its behavior across different environments in space. By examining various sulphur-bearing species, researchers reveal that these compounds can form strong connections with olivine, making it likely that they play an important role in the ongoing processes within the ISM.
The possibility for sulphur to remain trapped within the grain cores and the effects of charged species further enhance the understanding of how sulphur behaves in interstellar environments. These findings contribute to the broader understanding of elemental chemistry in space, particularly how essential elements like sulphur may influence the formation of stars and planets in the universe.
In summary, this research offers key findings that can aid in understanding the complex nature of sulphur in space, paving the way for further investigations into its implications for astrochemistry and the development of new planetary systems.
Title: Theoretical modelling of the adsorption of neutral and charged sulphur-bearing species on to olivine nanoclusters
Abstract: Sulphur depletion in the interstellar medium (ISM) is a long-standing issue, as only 1% of its cosmic abundance is detected in dense molecular clouds (MCs), while it does not appear to be depleted in other environments. In addition to gas phase species, MCs also contain interstellar dust grains, which are irregular, micron-sized, solid aggregates of carbonaceous materials and/or silicates. Grains provide a surface where species can meet, accrete, and react. Although freeze-out of sulphur onto dust grains could explain its depletion, only OCS and, tentatively, SO$_2$ were observed on their surfaces. Therefore, it is our aim to investigate the interaction between sulphur-containing species and the exposed mineral core of the grains at a stage prior to when sulphur depletion is observed. Here, the grain core is represented by olivine nanoclusters, one of the most abundant minerals in the ISM, with composition Mg$_4$Si$_2$O$_8$ and Mg$_3$FeSi$_2$O$_8$. We performed a series of quantum mechanical calculations to characterize the adsorption of 9 S-bearing species, both neutral and charged, onto the nanoclusters. Our calculations reveal that the Fe-S interaction is preferred to Mg-S, causing sometimes the chemisorption of the adsorbate. These species are more strongly adsorbed on the bare dust grain silicate cores than on water ice mantles, and hence therefore likely sticking on the surface of grains forming part of the grain core. This demonstrates that the interaction of bare grains with sulphur species in cloud envelopes can determine the S-depletion observed in dense molecular clouds.
Authors: Jessica Perrero, Leire Beitia-Antero, Asunción Fuente, Piero Ugliengo, Albert Rimola
Last Update: 2024-01-19 00:00:00
Language: English
Source URL: https://arxiv.org/abs/2401.10610
Source PDF: https://arxiv.org/pdf/2401.10610
Licence: https://creativecommons.org/licenses/by-nc-sa/4.0/
Changes: This summary was created with assistance from AI and may have inaccuracies. For accurate information, please refer to the original source documents linked here.
Thank you to arxiv for use of its open access interoperability.
Reference Links
- https://orcid.org/#1
- https://zenodo.org/10.5281/zenodo.8363882
- https://dx.doi.org/#2
- https://arxiv.org/abs/#1
- https://dblp.uni-trier.de/rec/bibtex/#1.xml
- https://doi.org/10.1016/0016-7037
- https://doi.org/10.1063/1.464304
- https://doi.org/10.1051/0004-6361/202141861
- https://ui.adsabs.harvard.edu/abs/2017SSRv..212....1C
- https://doi.org/10.1093/mnras/stz2430
- https://doi.org/10.1111/j.1365-2966.2012.21712.x
- https://ui.adsabs.harvard.edu/abs/2019ESC.....3.2390M
- https://ui.adsabs.harvard.edu/abs/2003A&A...406..899F
- https://ui.adsabs.harvard.edu/abs/2021A&A...647A..10G
- https://doi.org/10.1063/1.5011798
- https://doi.org/10.1051/0004-6361/201014821
- https://doi.org/10.1051/0004-6361/201834446
- https://doi.org/10.1038/s41550-022-01875-w
- https://doi.org/10.1007/s11214-005-8066-x
- https://ui.adsabs.harvard.edu/abs/2015A&A...577A..49N
- https://doi.org/10.1002/qua.560560414
- https://doi.org/10.1111/j.1945-5100.2007.tb00216.x