Characterization Of Organic Matter Research Articles

Discriminative characteristics of hydrochemical components and sedimentary organic matter in Korean coastal aquaculture systems during summer

Understanding the spatial distribution and sources of sedimentary organic matter (OM) in coastal environments is crucial for effective water quality management and the preservation of ecosystem health. Although extensive research has been conducted on OM dynamics, there remains a gap in understanding the ongoing biogeochemical processes in Korean coastal aquaculture zones, particularly during the summer season. To address this gap, we investigated the spatial variation of water chemical properties and isotopic composition of sedimentary OM to trace the composition, source, and reactivity of mixed OM in aquaculture systems along the Korean coast during the summer season. The isotopic approach was applied to surface sediments from five sections: western (W)-1, W-2, southern (S)-1, S-2, and eastern (E)-1. With respect to increased nutrients (mainly nitrate; 1.2 ± 0.6 mg/L) by dam-water discharge near W sections, our isotopic signatures revealed that a substantial fraction of sedimentary OM might dominantly originated from autochthonous OM source (algae; 36.5%) related to the increase of terrestrial nutrients. Simultaneously, the deposition of allochthonous OM (aquacultural feces; 44%) was predominant in the S-2 sections. The 34S-depleted patterns (approximately -7.2‰) in the S-2 section was indicative of active sulfate reduction occurring at the sedimentary boundary. Therefore, together with the precise determination of ongoing OM, our isotopic results provide valuable insights for effectively managing water-sedimentary qualities under the increase of anthropogenic contamination.

Effects of relative humidity on atmospheric organosulfur species derived from photooxidation and nocturnal chemistry in a forest environment

The molecular composition of organic aerosols in ambient PM2.5 was investigated at the northern foothills of Qinling Mountain region in central China during the summer of 2022. The molecular characteristics of organic matter were analyzed using ultrahigh performance liquid chromatography coupled with high-resolution Orbitrap mass spectrometry. The number of molecular formula assignments was dominated by organosulfur species (OrgS, on average 28–47% in total). Both the number and peak area of OrgS increased significantly with higher relative humidity (RH), while those of CHO and CHON species decreased, indicating the different impacts of RH on individual organic groups. The entire study period was divided into two distinct stages, including a low RH and a high RH period (LRH and HRH). The enhanced formation of CHOS with O>7 in HRH was primarily attributed to photochemical oxidation, whereas the increase in CHONS with O>7 was driven by enhanced NO3 radical-initiated oxidation under elevated RH conditions. Nearly 50% of OrgS presented only in HRH had aliphatic structures with C≥9. Although isoprene-derived organosulfates dominated the peak area across the entire period, the monoterpenes and long-chain alkanes-derived organosulfates largely increased in HRH. The strong correlations between aerosol liquid water content and OrgS containing high oxygen content (O>7) indicate that aqueous-phase reactions played a crucial role in multigenerational oxidation of OrgS. This study highlights the important effects of RH on the formation of OrgS, particularly for organosulfates derived from monoterpenes and long-chain alkanes.

Organic Matter Characteristics and Hydrocarbon Potential of Jurassic Sargelu Formation in X Well, Northern Iraq

Organic Matter Characteristics and Hydrocarbon Potential of Jurassic Sargelu Formation in X Well, Northern Iraq

Soil organic matter characteristics of four soil types under different conservation strategies across Hubei Province

AbstractSoil organic matter (SOM) plays key roles in sloping land erosion control. This study explores SOM content across Hubei Province, China, focusing on four soil types under various conservation strategies. Field samples (n = 243) were collected under 27 monitoring sites employing diverse conservation strategies in runoff plots. Results indicated substantial variability in SOM content among soil types, with calcareous soils exhibiting the highest levels (12.63 g kg−1). Conversely, red soils displayed the lowest SOM content (6.32 g kg−1). However, short‐term conservation strategies and their interaction with soil type did not significantly influence SOM. The findings underscore the intricate relationship between soil types and SOM dynamics. This study contributes to the understanding of SOM dynamics in diverse landscapes, offering valuable guidance for policymakers and land managers to apply practices in mitigating erosion and enhancing soil health.

Molecular-chemical characterization of soil organic matter in wetlands by pyrolysis-gas chromatography/mass spectrometry

The carbon cycle in ecosystems is fundamentally controlled by the composition and transformation of organic molecules. Alpine wetland soils have enormous carbon storage, but they are sensitive to climate change, and can easily shift from carbon sink to carbon source. However, we currently lack understanding in molecular-chemical composition of soil organic matter (SOM) in alpine wetlands. In this study, we tried to decipher molecular-chemical features of SOM in typical alpine wetlands using the pyrolysis-gas chromatography/mass spectrometry (Py-GC/MS). Results indicated that nitrogen-containing compounds were the most abundant moieties among pyrolytic products of SOM. More than 83 % of pyrolytic moieties had a molecular weight of no more than 200 Daltons and a H/C ratio of no more than 2.0. O/C ratio of most pyrolytic products were less than 0.5. A van Krevelen diagram potentially indicated that SOM in wetlands might consist of massive heterogeneous molecules where aromatic compounds and their derivatives served as the core, with aliphatic hydrocarbon molecules of varying carbon chain lengths attached externally. About 72.25 % of variances in SOM were explained by 50 pyrolytic products, of which toluene was the most important. A significantly negative relation was observed between molecular weight (MW) and abundance of pyrolytic products, while positive relations were found between H/C, O/C, and abundance of pyrolytic products. Our work implied that SOM in wetlands was mainly composed of molecules with low MW and aromatic function groups.

Differential hydrocarbon generation characteristics of organic matter with green algae and cyanobateria origins in the Permain Lucaogou Formation of the Santanghu Basin

Organic-rich fine-grained rocks are key carriers of unconventional oil and gas resources, making it crucial to understand their hydrocarbon generation and evolution characteristics. This study examines the fine-grained rocks of the second member of the Lucaogou Formation (P2l2) in the Tiaohu and Malang Sags of the Santanghu Basin, focusing on how different organic matter (OM) backgrounds - primarily green algae and cyanobacteria - affect hydrocarbon generation and crude oil properties. Kinetic analysis and hydrous pyrolysis experiments on shales rich in green algae, cyanobacteria, and their mixtures revealed that green algae - derived OM requires lower activation energy to initiate hydrocarbon generation, results in an earlier oil generation peak, and has a broader oil window. Conversely, cyanobacteria - derived OM needs higher activation energy to start hydrocarbon generation, has a later oil peak, and a more concentrated generation period. These findings led to two models: the "green algae origin - early hydrocarbon generation - early oil peak - broad oil window model" and the "cyanobacteria origin - late hydrocarbon generation - late oil peak - concentrated oil generation model." Correlation analysis showed that aromatic hydrocarbons, resins, and asphaltenes significantly degrade crude oil quality. Hydrous pyrolysis experiments indicated that the heavy component content (aromatic hydrocarbons + resins + asphaltenes) in liquid hydrocarbons follows the order: residual oil > absorbed oil > expelled oil, with content initially increasing and then decreasing with maturity, and the color change of liquid hydrocarbons in dichloromethane reflects heavy component content changes effectively. Calculations of density and viscosity of liquid hydrocarbons, based on heavy component content and crude oil properties, were compared with the longitudinal distribution of crude oil properties in the study area. Results show that the hydrocarbon generation characteristics of green algae and cyanobacteria control crude oil properties, highlighting significant intra-source differentiation in the P2l2 shale and validates the phase separation approach in hydrous pyrolysis experiments. The P2l2 shale, with its high OM content and substantial hydrocarbon generation, holds great potential for shale oil exploration, but both reservoir quality and crude oil property evolution under different OM backgrounds should be considered when selecting favorable areas.

Application of Optical-electron Correlative Microscopy for Characterization of Organic Matter

ABSTRACT Application of coal petrology is known to play significant role in several industrial sectors viz. thermal industries, steel industries, unconventional oil and gas fields. One important aspect of organic matter characterization, especially for unconventional oil and gas fields is the development of organic matter hosted porosity, and commonly Scanning Electron Microscopy (SEM) is used to study the same. While, SEM helps in understanding the nature of porosity developed in coals and shales, one significant limitation is that under SEM the different organic matter types can’t be distinguished, as all organic matter appears dark due to their lower atomic mass. Optical-electron correlative microscopy has recently gained importance for making advancement in addressing the abovementioned scientific gap. While this method has been found some usage for characterizing the dispersed organic matter in shales, only one work globally exists where the technique has been used for studying coals. In this work, possibly, for the first time, this technique is applied for characterizing three Indian coals from Korba basin, India, with the main objective of establishing necessary protocols for reliable imaging of different organic matter types under SEM. Our results establish that imaging under SEM using Backscattered electron (BSE) detector, the macerals and mineral matter were clearly discernible at 15 kV accelerating voltage. Further, this exercise also indicates that identification of vitrinite macerals under SEM, without correlative technique can be challenging, while some inertinites with their distinctive structures can be identified under stand-alone SEM. Sporinites too, due to their distinctive morphology, were easily identifiable under SEM.

Impact of dissolved organic matter characteristics and inorganic species on the stability and removal by coagulation of nanoplastics in aqueous media

The aggregation of rough, raspberry-type polystyrene nanoparticles (PS-NPs) was investigated in the presence of six hydrophobic and hydrophilic dissolved organic matter (DOM) isolates and biopolymers (effluent OM) in NaCl and CaCl2 solutions using time-resolved dynamic light scattering. Results showed that the stability of PS-NPs mainly depends on OM characteristics and ionic composition. Due to cation bridging, the aggregation rate of PS-NPs in Ca2+-containing solutions was significantly higher than at similar Na+-ionic strength. Biopolymers rich in protein and carbohydrate moieties showed higher affinity to the surface of PS-NPs than the other DOM isolates in the absence of both Ca2+ and Na+. Overall, the stability of PS-NPs followed the order of biopolymers > hydrophobic isolates > hydrophilic isolates in the presence of Na+ and biopolymers > hydrophilic isolates > hydrophobic isolates in Ca2+-containing solutions. In the presence of high MW structures (biopolymers), PS-NPs aggregation in both NaCl and CaCl2 solutions was attributed to steric repulsive forces. The impact of hydrophilic and hydrophobic isolates on PS-NPs aggregation highly relied on the ionic composition. Coagulation was an effective pretreatment for PS-NPs removal. Using inductively coupled plasma-mass spectrometry, higher removals were recorded with Al2(SO4)3 in the absence of DOM, while PACl more efficiently coagulated PS-NPs in the presence of DOM isolates.

Study on Grain Size, Physical Properties and Organic Matter Characteristics of Tidal Flat Surface Sediments: May 2022 Hwangdo Tidal Flat Dataset, Cheonsu Bay

This study analyzes the geological and geochemical features of surface sediments in the Hwangdo Tidal Flat, located on Korea’s West Coast. The tidal flat experiences semi-diurnal tides, impacting organic matter decomposition and nutrient cycling. Ninety one sediment samples were collected and analyzed for physical and chemical properties including grain size, density, water content, organic carbon, and nitrogen. Sediments consist mainly of sand and silt, with coarser sediments near the main channel and finer sediments towards the west. Sediment grain size averages 4.12 Φ with a sorting coefficient of 1.96 Φ, indicating diverse energy environments. Total organic carbon and nitrogen correlate positively with grain size and density, reflecting sediment origin and environment. Kriging maps sediment grain size distribution, while correlation and linear regression analyses show relationships between variables. High correlations exist between various parameters, aligning with tidal flat characteristics and aiding understanding of sediment transport and deposition. The study provides baseline data for understanding the tidal flat’s geological, geochemical, and physical aspects, valuable for remote sensing validation and environmental monitoring. The dataset is freely available for research and management purposes.

Characterization of sediment organic matter in the outer Yangtze River Estuary using stable isotopes, optical techniques, and FT-ICR-MS: Implications for the carbon burial mechanism

The burial of sediment organic matter (SOM) in the estuary and shelf plays an important role in the global carbon cycle. However, it is challenging to determine the source, composition, and burial of SOM in the coastal sea, especially at the molecular level. This was explored in the coastal area outside the largest Yangtze River of China with multiple techniques including elemental and stable isotopic analysis, absorption spectroscopy, fluorescence excitation-emission matrices coupled with parallel factor analysis (EEMs-PARAFAC), and ultra-high resolution Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR-MS). The end-member mixing analysis based on δ13C and δ15N showed a dominance of marine contribution (up to 70%) at most stations while the terrestrial contribution increased to >55% nearshore in summer at a high fluvial sediment flux. This was consistent with the offshore decreasing humic-like C1 and C2, humification index (HIX), %lignin-like compounds, and %CHO but increasing tryptophan-like C3, biological index (BIX), %protein-like compounds, and %CHOS from EEMs-PARAFAC and FT-ICR-MS analysis. The %clay correlated positively with SOM content, HIX, %lignin-like compounds, O/C, and modified aromaticity index (AImod) but correlated negatively with %C3, H/C, and the relative abundance of labile formulas (MLBL), while %silt showed contrasting correlations. These results indicated the fine clay sediments adsorbed more humified, aromatic, oxygenated, and terrestrial compounds that were probably more resistant to biodegradation and thus had a higher burial efficiency than those on the silty sediments. Principal component analysis based on SOM indices further revealed different characteristics of SOM in the nearshore, northern offshore, and southern offshore regions, which were probably dependent on the delivery by local current systems. Overall, these findings contributed to unraveling the source and molecular composition of SOM associated with different grain size sediments and local current delivery, which are fundamental for understanding the factors underlying carbon burial in the complex coastal environment.

Identifying sources and distribution of organic pollutants in a Moroccan river: Characterization of dissolved organic matter by absorption, excitation–emission fluorescence and chemometric analyses

This study investigates surface water contamination of Ben-Kazza River in Morocco, fed by effluents from an adjacent lagoon-based wastewater treatment plant (WWTP) and seasonally by industrial effluents, and which occasionally serves to irrigate agricultural fields. This study has two purpose: i) to track the main sources of contamination through the evolution of dissolved organic matter (DOM) characteristics along the watercourse, and ii) to characterize the WWTP influents and effluents with a focus on the efficiency of the lagoon treatment. We characterized a total of 495 water samples across the watercourse and from the inlet and outlet of the WWTP, using UV–visible absorption and excitation–emission fluorescence coupled with chemometric analyses. Absorption indicators and fluorescence indices were calculated and compared across sampling points. Results highlight spatial shifts together with temporal changes in DOM. PARAFAC identified components that varied between protein-like, humic-like and anthropogenic-like fluorophores along the river, permitted to trace the anthropogenic components and their sources. The lagoon treatment appeared to better remove fresh organic material than humic material: fluorescence intensity decreased by 68 % for peak T1 and by 22 % for peak C. Maximum fluorescence intensities (Fmax) decreased across all PARAFAC components, leading to more than 55 % reduction of ΣFmax.

Evaluation of the biodegradability of hazardous industrial solid waste: Study of key parameters.

The biological stability of solid waste is one of the main problems related to the environmental impact of landfills and their long-term emission potential. Current European legislation (European Landfill Directive, EC/99/31) introduced the need to reduce biodegradable organic compounds deposited in landfills; however, it set neither official parameters nor methods to define the stability of such a waste. In Spain, biodegradability is generally evaluated using the biological oxygen demand/chemical oxygen demand (BOD5/COD) ratio, measuring it on the leachate, thus not considering the non-soluble fraction and therefore creating false negatives. To solve this problem, the biodegradability of hazardous industrial waste has been determined by measuring its respirometric activity (AT4). Our results show that the measure of the AT4 is independent of the enrichment with a microbial inoculum, and a sample size no higher than 20g could be a reasonable value for a sensitive biodegradability determination. The highest respirometric index is obtained in waste with pH values between 6.5 and 10.5. Furthermore, respirometric biodegradability values are independent of traditional parameters of organic matter characterization such as BOD5/COD ratio, volatile content, and total and dissolved organic carbon. Consequently, the AT4 parameter provides new information on the composition and stability of organic matter in hazardous industrial waste. Its incorporation into pre-disposal waste characterization protocols allows to identify waste that exceeds recommended biodegradability thresholds. This approach ensures that only waste meeting specified biodegradability standards is deposited, avoiding landfill emissions and related environmental impacts, and thereby improving the overall effectiveness and sustainability of waste management practices.

Divergent response of Chernozem organic matter towards short-term water stress in Poa pratensis L. rhizosphere and bulk soil in pot experiments: A spectroscopic study

Understanding and controlling rhizospheric processes under abiotic stress is one of the key challenges in addressing food security amid the climate crisis. In this work, the impact of short-term drought and overwatering on soil organic matter (SOM) of Haplic Chernozem in the rhizosphere of Poa pratensis L. and in bulk soil was investigated. The vegetation experiment was conducted in a climatic chamber at soil moisture levels of 35, 80, and 200 % of the field capacity. UV-Vis and spectrofluorometry were used to describe the water-extractable organic matter (WEOM) characteristics and fluorofores signature, and diffuse reflectance infrared Fourier transform spectroscopy (DRIFTS) to describe functional group composition of SOM. Composition and properties of SOM and WEOM of Chernozem significantly change after exposure to short-term water stress. Drought does not affect the composition of rhizosphere SOM except increasing the proportion of polysaccharides, but leads to the decrease in aromaticity and increase in molecular weight of humic-like components of rhizosphere WEOM. These findings reflect Poa adaptation to water deficiency and microbial activity suppression which results in accumulation of SOM intermediate decomposition products. On the contrary, bulk WEOM wasn't affected by drought but SOM became enriched with aromatic and oxidised components. Overwatering leads to equalisation of bulk and rhizospheric SOM composition due to a decrease in the proportion of aromatic and carboxylic components of bulk SOM and the accumulation of microbial products in both bulk and rhizospheric SOM. In general, rhizospheric WEOM undergoes relatively significant changes relative to the optimum water regime under moisture deficit, and bulk WEOM — under overwatering. The findings illustrate the involvement of the both WEOM and SOM in maintaining resilience of the soil-plant system as well as the difference in watering conditions impact on SOM in rhizosphere and bulk soil. SOM spectral data can be used for assessing the state of soil systems, such as changes in microbial activity and adaptation of the soil-plant system to abiotic stress. Our findings also illustrate the differences in the organic matter transformation of the Poa pratensis rhizosphere and the bulk Chernozem depending on environmental factors.

Characteristics of organic matter driven by Eichhornia crassipes during co-contamination with per(poly)fluoroalkyl substances (PFASs) and microplastics (MPs)

Co-contamination with MPs and PFASs has been recorded, particularly in surface-water environments. Floating macrophyte microcosms are an important part of the surface water ecosystem, and dissolved organic matter (DOM) driven by floating macrophytes (FMDDOM) is critical for maintaining material circulation. However, knowledge gaps remain regarding the impact of MPs and PFASs co-pollution on FMDDOM. An greenhouse simulation experiment was conducted in this study to investigate the effects of four PFASs, perfluorooctanoic acid (PFOA), perfluoro-octane-sulfonic acid (PFOS), perfluoro-2-methyl-3-oxahexanoic acid (Gen X), and potassium 9-chlorohexadecafluoro-3-oxanonane-1-sulfonate (F-53B), on FMDDOM sourced from Eichhornia crassipes (E. crassipes), a typical floating macrophyte, in the presence and absence of polystyrene (PS) MPs. Four PFASs increased FMDDOM release from E. crassipes, leading to a 32.52–77.49 % increase in dissolved organic carbon (DOC) levels. PS MPs further increased this, with results ranging from −21.28 % to 26.49 %. Based on the parallel factor analysis (PARAFAC), FMDDOM was classified into three types of fluorescent components: tryptophan-like, humic-like, and tyrosine-like compounds. Contaminants of MPs and PFASs modified the relative abundance of these three components. Protein secondary structure analysis showed that fluorocarbon bonds tended to accumulate on the α-helix of proteins in FMDDOM. The relative abundance of fluorescent and chromophorous FMDDOMs varied from 0.648 ± 0.044 to 0.964 ± 0.173, indicating that the photochemical structures of the FMDDOM were modified. FMDDOM exhibits decreased humification and increased aromaticity when contaminated with MPs and PFASs, which may be detrimental to the geochemical cycling of carbon. This study offers a theoretical basis for assessing the combined ecological risks of MPs and PFASs in floating macrophyte ecosystems.

Analysis of dissolved organic matter characteristics in pharmaceutical wastewater via spectroscopy combined with Fourier-transform ion cyclotron resonance mass spectrometry

Studying the changes in organic matter and characteristic pollutants during the treatment of penicillin-containing pharmaceutical wastewater, which can be reflected by changes in dissolved organic matter (DOM), is crucial for improving the effectiveness of wastewater treatment units and systems. Herein, water quality indicators, spectroscopic methods, and Fourier-transform ion cyclotron resonance mass spectrometry were utilized to characterize the general molecular compositions and specific molecular changes in DOM during the treatment of typical penicillin-containing pharmaceutical wastewater, including in each of the influent, physicochemical treatment, biological treatment, oxidation treatment, and effluent stages. The influent exhibited a high organic matter content (concentration of dissolved organic carbon >10,000 mg·L−1), its DOM mainly contained protein- and lignin-like substances composed of CHON and CHONS molecules, and the relative intensity (RI) of penicillin was extremely high (RI = 0.220). Compared with the influent, the abundance of CHON and CHONS molecules detected after physicochemical treatment decreased by 70.3 % and 62.5 %, respectively, and the RI of penicillin decreased by 85.5 %. Biological treatment caused substantial changes in DOM components through oxidation, dealkylation, and denitrification reactions, accounting for 36.8 %, 28.9 %, and 14.8 % of the total identified reactions, respectively. Additionally, lignin-like substances were generated in large quantities, the overall humification level significantly increased, and the RI value increased for the penicillin intermediate, 6-aminopenicillanic acid (6-APA). Oxidation treatment effectively removed phosphorus-containing substances and some lignin-like substances produced by biological treatment; however, it was not effective in removing characteristic pollutants such as 6-APA. Such characteristic substances continued to be present in the effluent, and the DOM mainly contained protein- and humus-like substances, accounting for 30.8 % and 47.3 %, respectively. The study findings reveal the changes in organic matter and characteristic pollutants during the treatment of penicillin-containing wastewater from the perspective of the general molecular composition and specific molecular changes in DOM, providing support for further exploration of wastewater treatment mechanisms and improvements in treatment unit efficiency.

Influences of wildfire on the soil dissolved organic matter characteristics and its electron-donating capacity

Global increases in the intensity and frequency of wildfires are driving major changes in soil organic matter (SOM) characteristics, including soil dissolved organic matter (DOM). As the most crucial component of SOM, soil DOM plays a pivotal role in the carbon cycle and regulates the environmental fate of contaminants through its versatile reactivities, including electron-donating capacity (EDC). However, it is still being determined how wildfire influences key characteristics of soil DOM and subsequent effects on EDC in forest soils. Thus, we conducted our study to fill this gap with the forest soils of Jinyun Mountain Nature Reserve of China, which experienced an unprecedented wildfire event in 2022. The results from optical characterization, high-performance size-exclusion chromatography (HPSEC), and Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR-MS) showed decreasing molecular weight but elevating nitrogen-containing molecular formulas of soil DOM in the burned soils. This could be attributed to the Maillard reaction and microbial re-colonies. Additionally, wildfires increased the condensed aromatics and lignin components in soil DOM. In the burned soils, we observed increasing EDC of soil DOM, which accounts for an increase in lignin-derived phenolic components. Overall, the findings of this study demonstrate that eco-disturbances, such as wildfires, induce alterations in the properties of DOM, leading to variations in its reactivity and potentially influencing the fate of environmental pollutants beyond carbon dynamics alone. Thus, incorporating the dynamic properties of soil DOM, particularly in the context of climate change, can enhance the assessment of risks associated with contaminants in soil and water, providing valuable insights.

Tracing fluorescent dissolved organic matter (fDOM) characteristics and water quality parameters: Insights from an urban industrial river to marine zone.

This study aims to identify continuous water quality changes and identify fluorescence properties from urban rivers to marine zones. Various types of natural and anthropogenic sources derived dissolved organic matter (DOM) have been identified in this study. These include soil-derived DOM, plant remnants, and soluble particles produced when organic material partially decomposes and is released by microorganisms, such as bacteria, algae, and plants. DOM was characterized using a three-dimensional excitation-emission matrix (3DEEM), parallel factor analysis (PARAFAC), and water quality parameters from the Buriganga River, Dhaka to Patenga Seaport, Chittagong, along with the Shitalakshya River, a small portion of the Padma River, and the Meghna River. To better understand the data analysis, the study area was divided into three central regions: urban industrial rivers, industrial estuarine rivers, and marine zones. In the urban industrial river, 3DEEM and PARAFAC identified five fluorophores (peaks: A, C, M, T, and Tuv) with five components: detergent-like, fulvic-like, tryptophan or protein-like, fulvic-like (C-type), and protein-like, which might originate from the industrial activities and sewage pollution. In the industrial estuarine river zone, three fluorophores have been identified (peaks: A, C, Tuv) with two known components, namely, fulvic acid (A-type) and fulvic acid (C-type), with an unknown photoproduct at Ex/Em = 295/368 (peak Tuv). Components in the industrial river zone may originate from terrestrial sources, indicating vegetation along the river. In the marine zone, four fluorophores have been identified (peaks: Tuv, A, T, C) with two components, that is, protein- or tryptophan-like and humic acid-like from coral origin. The intensities of both fulvic-like and protein-like substances were high in urban industrial river water owing to industrial activity and sewage pollution. SUVA254 suggests high aromaticity in all three regions, whereas the optical properties suggest that terrestrial and microbial components are present in the urban industrial and estuarine rivers. This further indicates that urban industrial river water quality is highly polluted. The lowest degradation potential index (DPI) in the marine zone might result from the presence of the highest number of dissolved solids in the water, and the highest DPI of industrial estuarine rivers explains the comparatively high presence of terrestrial-derived humic (A)- and humic (C)-like components in the ratio to the unknown photoproduct of mid-wavelength. PRACTITIONER POINTS: This study's uniqueness is a 220-km cruise from an urban river to a coastal seaport to analyze fluorescence properties. The study found that most water parameters were within the DoE standards, except for DO, which was consistently low. 3DEEM-PARAFAC identified five fluorophores linked to detergent, fulvic, and protein-like substances from sewage and industrial sources. Our study concludes that microbial and terrestrial sources dominate dissolved organic matter in urban, estuarine, and marine regions.

Depositional environments and thermal maturity of the hydrocarbon source rocks in the Devonian–Early carboniferous Ora Formation from palynological organic petrographic investigations in northern and western Iraq

The study investigates the palynofacies, organic matter character, and hydrocarbon generation potential of this rock unit, based on surface and subsurface samples from the Ora Formation type-section in extreme northern Iraq and the Akkas-3 well in western Iraq, respectively. Dark, mostly oxidized, gelified platy amorphous organic matter (AOM) dominates the palynological components in the surface section, in addition to a few rounded spores and structured phytoclasts. In contrast, palynomorphs, including Ambitisporites avitus, Aneurospora spp., Vallatisporites verrucosus, Acinosporites spp., Verrucosisporites nitidus and the algae Botryococcus, are predominant in studied samples from the Akkas-3 well. Statistical cluster analysis identified three palynofacies types in the surface section based on stratigraphic variations in the particulate organic matter. These vary from high amorphous organic matter (AOM), moderate phytoclast, and low palynomorph abundances that represent proximal suboxic–anoxic shelfal environments to moderate to good AOM and low to moderate palynomorph abundances that represent distal suboxic–anoxic or distal dysoxic–anoxic shelfal environments. The organic petrographic study of the outcrop section also revealed the strong effect of oxidation, where dispersed terrigenous and amorphous organic materials in the form of granular and gelified forms dominate and reflect a terrestrial origin of these components. In the subsurface section, a mixed terrestrial and less marine or lacustrine origin characterized the studied organic matter, where land plant spores (sporinite), in addition to vitrinite and inertinite, are dominant with a few scattered liptinite macerals. The difference in thermal maturity between the outcrop and subsurface samples is likely due to the higher tectonic burial of the outcrop samples that form part of the Northern Thrust Zone of Iraq. Nevertheless, higher abundances of AOM (oil-prone kerogen type II) accumulated in the northern outcrop type section. This might imply that the Ora Formation has a higher potential for hydrocarbon production north of the Akkas field.

Organic Matter Enrichment in Jurassic Hydrocarbon Source Rocks from the Turpan-Hami Basin: Insights from Organic and Elemental Geochemistry.

Petroleum can be generated by thermal cracking of organic matter within sediments, and the organic matter within sediments plays the dominant role in determining oil and gas generation. Organic matter within sediments is characterized by various sources, such as sapropelic organic matter from algal, microbial, and planktonic organisms and humic organic matter from higher plants. Paleo-productivity, terrestrial influx, and depositional environments could obviously influence the enrichment processes of the organic matter within sediments. Organic and elemental geochemical proxies can investigate the sedimentary process and reflect the enrichment characteristics of organic matter. In this study, hydrocarbon source rocks from the Shuixigou Group were collected from the Taibei Sag of the Turpan-Hami Basin, rock-eval pyrolysis was conducted, and stable carbon isotope composition of organic carbon and major and trace element distributions were measured. Based on this, the type and maturation of organic matter, paleo-productivity, terrestrial influx, and depositional paleo-environments were investigated. The results show that the Jurassic hydrocarbon source rocks are characterized by type III kerogen and are in the oil-window stage of maturation. The depositional paleo-environments of hydrocarbon source rocks in different formations are not remarkably different. The water bodies have freshwater oxidizing environments, and the paleo-climatic characteristics are warm and humid. However, the paleo-productivity of samples from the lower Jurassic Sangonghe Formation is higher than samples from other formations. Overall, the organic matter enrichment in Jurassic hydrocarbon source rocks of the Turpan-Hami Basin could be mutually controlled by the paleo-productivity and depositional paleo-environments. The results of this study could provide theoretical insight into deep petroleum exploration and resource evaluation in the Turpan-Hami Basin.

Molecular Structural Characteristics and 3D Model Reconstruction of Organic Matter in Longmaxi Formation Shale.

The establishment of molecular structure modeling is an important means to study the pore characteristics of shale organic matter and is significant for molecular-level simulations of gas storage and diffusion. Using 13C NMR, FTIR, and XPS combined with the split-peak fitting technique, the structural characteristics of the aromatic structure, aliphatic structure, and oxygen functional groups of kerogen from the shale of the Longmaxi Formation, Wuxi County, Chongqing Municipality, were quantitatively characterized. A macromolecular structure model of the kerogen was also constructed by using the 2D macromolecular structure model construction method in combination with elemental analysis experiments. The results showed that the 2D single-molecule structural model of the sample consisted of 2 benzenes, 2 naphthalenes, 1 anthracene, 5 pyrenes, 1 pyridine, and 1 pyrrole. The C skeleton types were 93 protonated arylons, 39 bridged arylons, 6 carboxylons, 5 alkyl-substituted carbons, 2 oxygen-substituted carbons, 4 methylene carbons, and 3 methylons. The established 2D molecular structure formula was C152H82O12N2. The final 3D macromolecular structure model consisted of 14 2D molecular structures (structural formula C2128H1148O168N28), with the density set to 1.77 cm3/g, compressed in a cubic cell with an edge length of 3.05 nm. Finally, the adsorption results showed that the experimental adsorption of CO2 adsorption was less than the simulated adsorption, completing the validation of the model. The above study provides a method for determining the molecular structure of kerogen in the Longmaxi Formation shale, which can guide the study of the pore structure characteristics of the Longmaxi Formation shale.