Nuclear magnetic resonance studies of ancient buried wood—II. Observations on the origin of coal from lignite to bituminous coal

Coalified logs ranging in age from Late Pennsylvania to Miocene and in rank from lignite B to bituminous coal were analyzed by ¹³C nuclear magnetic resonance (NMR) utilizing the cross-polarization, magic-angle spinning technique, as well as by infrared spectroscopy. The results of this study indicate that at least three major stages of coalification can be observed as wood gradually undergoes transformation to bituminous coal. The first stage involves hydrolysis and loss of cellulose from wood with retention and differential concentration of the resistant lignin. The second stage involves conversion of the lignin residues directly to coalified wood of lignitic rank, during which the oxygen content of intermediate diagenetic products remains constant as the hydrogen content and the carbon content increases. These changes are thought to involve loss of methoxyl groups, water, and C₃ side chains from the lignin. In the third major stage of coalification, the coalified wood increases in rank to subbituminous and bituminous coal; during this stage the oxygen content decreases, hydrogen remains constant, and the carbon content increases. These changes are thought to result from loss of soluble humic acids that are rich in oxygen and that are mobilized during compaction and dewatering. Relatively resistant resinous substances are differentially concentrated in the coal during this stage. The hypothesis that humic acids are formed as mobile by-products of the coalification of lignin and function only as vehicles for removal of oxygen represents a dramatic departure from commonly accepted views that they are relatively low-molecular-weight intermediates formed during the degradation of lignin that then condense to form high-molecular-weight coal structures.     

低熟煤型气的成因化学

用水介质热压模拟、_１３Ｃｎｍｒ分析表明，Ｒｏ＝０.７%以前，煤型有机质中的芳环结构的变化主要是官能团的变化，芳环仍然保留着单环的结构特征，并未发生明显的缩合作用。即在早期热演化过程中由邻甲氧基苯酚结构向邻苯二酚类结构转化，进而转化为烷基酚类结构，同时脱去甲氧基中的甲基。甲氧基含量从Ｒｏ＜０.３%开始迅速减少，到Ｒｏ＝０.７%时已基本脱除完毕。煤型有机质中的甲氧基在热演化早期通过自由基反应脱去甲基，对低熟煤型气有重要贡献。     

Coalification of organic matter in coal balls of the Pennsylvanian (upper Carboniferous) of the Illinois Basin, United States

An evaluation was made of the degree of coalification of two coal balls from the Illinois Basin of the Pennsylvanian (upper Carboniferous) of the United States. Previous interpretations are mainly misleading and contradictory, primarily because of the assumption that the brown color and exceptional cellular and subcellular preservation typical of American coal balls imply chemical preservation of cellulose and lignin, the primary components of peat. Xylem tissue from a medullosan seed fern contained in a coal ball and the coal attached to the coal ball from the Calhoun coal bed, Mattoon Formation, Illinois, was analyzed by elemental, petrographic, and nuclear magnetic resonance (NMR) techniques to determine the degree of coalification. The NMR and elemental data indicate the lack of cellulose and lignin and a probable rank of high-volatile C bituminous coal. These data corroborate data for a coal ball from the Herrin (No. 6) coal bed (Carbondale Formation, Middle Pennsylvanian) and support our hypothesis that the organic matter in coal balls of the Pennsylvanian strata of the United States is coalified to about the same degree as the surrounding coal. Data presented show a range of lower reflectances for xylem tissue and vitrinite in the analyzed coal balls compared with vitrinite in the attached coal.The data reported indicate that physical preservation of organic matter in coal balls does not imply chemical preservation. Also our study supports the hypothesis that compactional (static load) pressure is not a prerequisite for coalification up to a rank of high-volatile C bituminous coal.A whole-rock analysis of the Calhoun coal ball indicates a similarity to other carbonate coal balls from the United States. It consists primarily of calcium carbonate and 1–2% organic matter; silica and alumina together make up less than 0.5%, indicating the lack of minerals such as quartz and clays.     

Detection of tannins in modern and fossil barks and in plant residues by high-resolution solid-state C nuclear magnetic resonance

Bark samples isolated from brown coal deposits in Victoria, Australia, and buried wood from Rhizophora mangle have been studies by high-resolution solid-state nuclear magnetic resonance (NMR) techniques. Dipolar dephasing ¹³C NMR appears to be a useful method of detecting the presence of tannins in geochemical samples including barks, buried woods, peats and leaf litter. It is shown that tannins are selectively preserved in bark during coalification to the brown coal stage.     

Chemistry of alkali extraction of brown coals—I. Kinetics, characterisation and implications to coalification

Three Australian brown coals have been separated into humin and humic acid fractions and studied by high resolution solid state ¹³C NMR spectroscopy and Fourier transform IR spectroscopy. The aromatic rings of the humic acids are highly substituted showing that extensive cross linking must have occurred during formation from wood lignin and tannin. However, the humins contain more aliphatic carbon and hydrogen than the corresponding humic acids. This shows that little cross linking has occurred with other components of the brown coal such as resins, waxes cutin and algal detritus, and cross linking has not rendered the aromatics alkali insoluble. The kinetics of extraction are complex and not simple first order. This is reflected in the chemical composition of the humic acid which is extraction temperature dependent. We also observed that there is a conversion of aromatic carbon to aliphatic carbon and gas during extraction, probably by alkaline oxidation, resulting in ring opening. A range of suitable model compounds have been studied to confirm this finding. Such a mechanism may account for the modification of lignin in oxidising environments such as those occurring in the initial stages of coalification (lignite or brown coal formation) and in soils.     

Petrologic studies of terrestrial organic matter in Carpathian flysch sediments, southern Poland

In the Carpathian Flysch, coal is present either as exotics of Carboniferous coal deposits or as autochthonous, thin layers of lustrous coal. This paper present the results of the studies of coal-bearing rocks that are coeval with the enclosing flysch sediments. These coals form lenses up to 0.15 m thick. Their morphology precludes an exotic origin. The main petrographic component is collinite with admixtures of poorly fluorescing telinite. Minor components are: exudatinite, sporinite, fusinite, micrinite and sclerotinite. Mineral matter consists of framboidal pyrite clay minerals and quartz.The random reflectance of telocollinite varies from 0.38% to 0.72%, which corresponds to subbituminous and bituminous ranks. Correlation between chemical analysis, coking properties and relfectance measurements, leads to the conclusion that boundary between subbituminous and bituminous coals should be defined by the following values: C=80wt%, VOLATILES=43wt%; calorific VALUE=32.3 MJ/kg; and R^o=0.56–0.57%.Atypical properties, such as: upper C value (75–80wt%); high volatile matter contents (over 43wt%) and low random reflectance (^o about 0.38–0.57%) in subbituminous coals; low C value (about 80–82wt%); low reflectance (0.56–0.72%); and good coking properties, of the bituminous coals are attributed to quick coalification during increasing temperature as a result of tectonic stress.     

Coal mine workers' pneumoconiosis

 The fibrogenic and cytotoxic potential of coal mine dust is independent of the amount of quartz and other inorganic parameters. Results of coal petrographical and organic geochemical investigations of coals and coal mine dust from the Ruhr and Ibbenbüren Region of Germany demonstrate variations of organic dust amount possibly influencing these noxious properties. Coal mine dust of high rank coals is characterized by a pronounced fibrogenic risk. This risk, independent of the quantity of quartz, is probably based on shape variations of different coal macerals. With increasing coalification of the corresponding seam, the vitrinite is enriched in its dust; however, lower concentrations have been determined for inertinite. Vitrinite shows constant shapes and sizes independent of the rank of coal. Inertinite particles with elongated to fibrous shapes tend to larger sizes with increasing coalification. Strikingly, coal mine dust from miners' lungs with high degrees of coal mine workers' pneumoconiosis (CWP) is enriched in inertinite. In contrast, high cytotoxicities in cell tests are known for coal mine dust from low coalified coals. High concentrations of phenolic compounds can be extracted by dichloromethane from low coalified coal mine dust. These compounds, which are characterized by a high water solubility and therefore high bioavailability, explain the high cytotoxicities of coal mine dust. Contamination of dust by diesel emissions in the coal mine can act as additionally supporting parameters for extended cytotoxicities. Received: 18 August 1995 · Accepted: 15 October 1995     

Pennsylvanian coalified rhizomorphs in Illinois: evidence for non-compressive coalification to bituminous coal rank

Irregular and discontinuous coalified objects, here termed rhizomorphs, occur above the Summum (No. 4) Coal Member (Carbondale Formation) at one locality in La Salle County, Illinois. These vitrinite structures, varying between 3 mm and 4 cm in diameter, occur in a blocky to structureless mottled claystone characterized by numerous carbonaceous streaks and small-scale slickensides. The rhizomorphs twist and bend in a tightly coiled and kinked pattern, and may extend laterally through the claystone for 40 cm or more before bifurcating or terminating. The rhizomorphs display little or no evidence of compressive distortion. They are composed of two types of material: structureless bright conchoidal collinite; and cellular woody structure. One or more vascular bundles occur as discrete steles within a groundmass of collinite gel; these are generally aligned longitudinally within the coal except where steles diverge laterally as offshoots. The rhizomorphs are believed to be a diagenetic derivative of rooting structures; this is based on their occurrence in an underclay-like sediment and on their irregular, kinked form, which differs from that of most vertical supportive plant stems. Non-compressive coalification of the plant material may have occurred through: (1) aerobic alteration of cell walls to non-compressive inertinite; (2) centripetal contraction and selective degradation of plant tissue; and (3) impregnation of more resistant stelar elements by organic gel derived from degradation of thin-walled tissue.     

C NMR, micro-FTIR and fluorescence spectra, and pyrolysis-gas chromatograms of coalified foliage of late Carboniferous medullosan seed ferns, Nova Scotia, Canada: Implications for coalification and chemotaxonomy

The cuticles and cuticle-free compressions of three Carboniferous medullosan seed-fern leaf species (Macroneuropteris scheuchzeri, Neuropteris ovata var. simonii and Alethopteris lesquereuxii) were analyzed by elemental, ¹³C nuclear magnetic resonance (NMR), micro-FTIR (Fourier transform infrared) and coal petrographic techniques. The 13C NMR spectra of the cuticle-free compressions and the associated whole coal (high volatile A/B bituminous coal rank) are generally similar and consist of a large aromatic carbon peak, a smaller aliphatic carbon peak and a shoulder on the aromatic peak, representing phenolic carbons. In contrast, the ¹³C NMR spectra of the cuticles from the same leaves have a predominant peak for aliphatic carbons and a much smaller aromatic carbon peak. This difference in aromaticity between the cuticles and the cuticle-free compressions is also reflected in the higher atomic H/C ratios of the cuticles. Micro-FTIR spectra of the cuticles show oxygenated functional groups (carboxyl and ketone) similar to those in modern cuticles but their most characteristic feature is very strong bands in the aliphatic stretching region. The cuticle-free compressions (mainly vitrinite), in turn, show the absence or significant reduction in oxygenated functional groups, reduction in aliphatic stretching bands and, usually, increased absorbance of aromatic out-of-plane deformation in the 700–900 cm⁻¹ region. Fluorescence spectra for the cuticles from all three species show a great similarity with a λ_max at 580–590 nm, probably reflecting a similardegree of coalification, which is consistent with the similar vitrinite reflectance (R_r) and H/C and O/C ratios of the cuticlefree compressions.These results indicate that leaf cuticle-free compressions, which were initially cellulose rich ( 90% cellulose and hemicellulose, < 10% lignin), can alter, during peatification and coalification, to a macromolecular structure similar to that of coalified wood (initially 50% cellulose and hemicellulose, 30%–50% lignin). Thus, a lignin-enriched structure is not a prerequisite for the formation of the macromolecular structure of vitrinite. In addition, the micro-FTIR spectra reveal the complexity of the molecular structure in coalified seed-fern leaves. The micro-FFIR data reveal some significant differences among the cuticles that may be of chemotaxonomic value. Clearly, a combination of macro- and micro-techniques offers a better basis for the interpretation of the molecular structure of pre-macerals and their alteration during peatification and coalification. Also, the data presented in this paper provide important new information that extends the data from morphological and cuticular taxonomic studies of some seed ferns. The data are encouraging preliminary advances in the chemotaxonomy of medullosan seed fern species.Pyrolysis-gas chromatography (PY-GC) data for the cuticles of three seed-fern leaves indicate distinct chemical signatures for the two neuropterid leaves as compared to the Alethopteris leaf. This perhaps indicates a chemotaxomic factor, or it could be related to the greater thickness of the cuticle of Alethopteris. Mass spectrometric data are needed to identify individual components in the PY-GC chromatograms.     

Some inter-relationships of kerogen and humic acid fractions in the Victorian brown coal pale lithotype

The structural relationship between the kerogen, humic acid and solvent extractable acid fractions in a Victorian brown coal pale lithotype have been examined by IR, solid state ¹³C-NMR, elemental analysis and pyrolysis-gas chromatography. The solvent extractable acids and the kerogen fractions are highly aliphatic which is somewhat unusual, whereas the humic acids are composed substantially of phenolic constituents of probable lignin origin. This coal lithotype is an unusual low rank coal because of its high humic acid content. Its repeated occurrence over the limited depth profile examined here precludes a variation in coalification effects. The data suggest independent biological origins for the humic acid and kerogen fractions, and at the current level of maturation, the humic acid to kerogen transformation is little advanced in the pale lithotype. The kerogen is surprisingly aliphatic which suggests a more open marine (or lacustrine) environment than previously supposed.     

Coalification stages from confined pyrolysis of an immature humic coal

An immature humic coal (subbituminous rank) from the Mahakam delta (Kutei basin, Kalimantan, Indonesia) was isothermally pyrolyzed in confined conditions at temperatures ranging from 250 to 400°C (10°C steps) at 700 bar pressure for 72 h. Solid, liquid and thermodesorbable phases originating from the pyrolyzates have been analyzed by different analytical techniques. Results indicate that a 10°C pyrolysis step is necessary to determine the timing and the sequence of the different transformations affecting the kerogen as well as the effluents. Four maturation/coalification stages are distinguished. Stage 1 (75–80 wt.% C) occurs when modifications mainly concern the oxygen-bearing functions of the kerogen. Stage 2 (82–85 wt.%o C) is characterized by the decrease of the aliphaticity and the primary cracking of the coal. Stage 3 (86–89 wt.% C) corresponds to the production of methane and the condensation of aromatic rings in the solid residue.     

早期煤化作用机制与有机质早期成烃演化

近年来，未熟和低熟油气田的发现、生物气藏的勘探和开发，极大地促进了对有机质早期转变的研究；而有机质早期转变机制的正确认识对于煤和干酪根中显微组分的成因、后期热演化都有着重要的影响。对早期煤化作用机制和有机质早期成烃作用的研究现状、进展及存在的问题进行了综述。     

Preliminary investigation on the metamorphism of Chinese coals

The fact that most Chinese coals are of a relatively high degree of coalification indicates that the metamorphism of Chinese coals has its own characteristics. As contact metamorphism and dynamic metamorphism have influenced the coals only to a restricted extent, they are not the causes of this distinguishing feature. Though geothermal metamorphism of coal occurs universally in China, the maximum subsidence as reflected by the thickness of coal measures and their overlying rock series is so small that the palaeo-temperature to which most Chinese coals were subjected was low and only low-ranking coals were formed. Hence, geothermal metamorphism is also not the principal cause of the higher ranking Chinese coals. Next to temperature, time is an important factor in geothermal metamorphism; the degree of coalification is dependent on the temperature and duration of heating that the coal has undergone.It is inferred that palaeogeothermal anomalies ought to be held responsible for most of the higher ranking Chinese coals. They are principally caused by magmatic intrusions, or by deep-seated faults, or by the uplift of the Moho with the corresponding uplift of the asthenosphere, and these three causes are interrelated. Telemagmatic metamorphism has so widely influenced Chinese coals that it accounts mainly for the majority of higher-rank Chinese coals. Consequently Chinese coals have first and universally been coalified by geothermal alteration to lower rank and then partially promoted by telemagmatic metamorphism to medium and high ranks. Based upon the patterns of magmatic intrusions and associated hydrothermal processes, the telemagmatic metamorphism of Chinese coals can be tentatively divided into the following types: (1) type a, produced mainly by hypabyssal or meso-epimagmatic intrusions; (2) type b, produced mainly by hydrothermalism from blind intrusive bodies; (3) type c, produced mainly by mesoepimagmatic and epimagmatic intrusions; and (4) type d, produced mainly by hydrothermalism and epimagmatic intrusions. Characteristics of coalification zones, wall rocks and coal itself may be used as criteria to differentiate the telemagmatic metamorphism from other kinds of metamorphism. Magmatic activities which caused the telemagmatic metamorphism and its extent are controlled by structural systems, especially by the latitudinal structural systems and other structural systems associated with the former.     

Isotopenvariationen des Stickstoffs humoser und bituminöser natürlicher organischer Substanzen

gd¹⁵N-values and nitrogen contents of a series of humic and bituminous organic sediments of different ranks were determined. The change of the isotopic abundance of nitrogen was investigated during heating in model experiments, using a gas flame coal.In the case of humic carbon coals the relative nitrogen contents vary from 0.8 to 1.4% and the δ¹⁵N-values from +3.5 to +6.3%. increasing from the brown coal to anthracite ranks. During the coalification process both the δ¹⁵N-values and the relative nitrogen contents do not vary continuously with the rank, but pass through maxima and minima. Model experiments using a gas flame coal show the same trend. Nitrogen with δ¹⁵N-values of +2.8 or ?7%. was released in pyrolysis experiments, applying a gas flame coal and a steam coal at temperatures of 650 and 1000°C, respectively.The investigated bitmuinous sediments yielded relative amounts of 0.1 to 0.8% with δ¹⁵N-values of + 4.2 to + 10.7%.The obtained results are discussed with respect to the elucidation of nitrogen genesis in natural gas deposits.     

An evaluation of Rock-Eval pyrolysis for the study of Australian coals including their kerogen and humic acid fractions

Rock-Eval pyrolysis was performed on lithotype and depth profiles of Tertiary brown coals and a coalification profile of Permian bituminous coals. The humic acid and kerogen fractions from the coals are also investigated by this technique along with the effect of base extraction on the kerogen fraction. Structural variations between brown coal lithotypes are primarily reflected by changes in Oxygen Index Value. This result was supported by the results from the depth profile (same lithotype). A wide range of Hydrogen Indices (independent of depth) but similar Oxygen Indices were observed. The results from the Qualification profile show that the Oxygen Indices varied with rank, whereas Hydrogen Indices show a greater dependence on coal type. A plot of $\text{H}\text{C}$versus Hydrogen Index produced good correlations with the brown (0.77) and bituminous (0.90) samples lying on two separate lines intersecting at high H/C. This result (and higher correlation for bituminous samples) reflects the expected dependence of hydrogen index on oxygen content (present primarily as hydroxyl groups). A high correlation (0.95) between quantitative IR data (K 2920 cm mg^?1) and Hydrogen Indices supports previous conclusions regarding the dependence of Hydrogen Indices on the aliphatic structure of the samples.     

Coalification and graphitization in high-pressure schists in New Caledonia

The northern portion of the Tertiary high-pressure schist belt in New Caledonia contains, from west to east, a metamorphic progression from lawsonite-albite facies through glaucophanitic greenschists to eclogitic albite-epidote amphibolites. This belt is flanked to the west by Upper Cretaceous-Eocene metasediments, of prehnite-pumpellyite grade. Paraschists throughout this whole sequence contain abundant carbonaceous material which shows a progressive metamorphism from coal to graphite. Structural analysis of lithostatic load and oxygen isotope data have provided a PT profile for the carbon metamorphism. In the prehnite-pumpellyite metasediments, phytoclasts were progressively coalified to anthracite rank under PT conditions which extended up to 3 kb/255 ° C at the lawsonite isograd where graphite first appears. On the high grade side of the lawsonite isograd a transitional mixed zone of continued coalification and graphitization occurred within the PT range 3 kb/255 ° C to 5.5 kb/335 ° C which included the ferroglaucophane isograd. Immediately beyond this zone all phytoclasts were completely graphitized before the epidote isograd was reached at 6.3 kb/ 390 ° C. The prevailing metamorphic environment retarded coalification, but accelerated graphitization, under conditions of high pressure and a low temperature gradient (7 ° C/km) that had been generated within the sedimentary pile by rapid tectonic thickening and consequent deep burial.     

Facies analysis of coal seams from the Cracow Sandstone Series of the Upper Silesia Coal Basin, Poland

The main purpose of this study was to recognise the variability of petrographical structure of two coal seams occurring in the Cracow Sandstone Series (Upper Carboniferous/Pennsylvanian, Upper Westphalian), being exploited in the Siersza mine. This mine is located in the eastern part of the Upper Silesia Coal Basin (USCB). The chemical analyses and petrographical features allow the inclusion of these coals to the group of hard brown coals belonging to subbituminous class.Two coal seams (207 and 209/210) of a considerable thickness (7.44 and 6.54 m, respectively), representative of the Cracow Sandstone Series (CSS), were chosen for the petrographic studies. Dominant macroscopic constituents of both seams are banded bright coal and banded coal.The coal seams were sampled in 284 intervals using a channel profile sampling strategy. The microscopical examinations revealed the majority of macerals from the vitrinite group (55%), followed by inertinite (21%), liptinite (11%), and mineral matter (13%). Low values of the vitrinite reflectance (R_o=0.46%) confirm very low coalification of the coal in both seams. Facies analysis indicates that in the course of a mire development, in which the studied coal seams originated, wet forest swamp conditions dominated characterized by a high degree of flooding and gelification as well as by a prevalence of arborescent plants. In such conditions, lithotypes with a large content of bright coal were mainly formed. Petrographic and facies data point to the rheotrophic character of these peatbogs. Frequent changes of the conditions in the peatbog, as it is shown by the variability of petrographic structure of the studied profiles, as well as by lateral changes of the phytogenic sedimentary environment within the coal seams, indicate a strong influence of a river channel on the adjoining peatbogs. An accretion of clastic sediments within the wide river channel belts was balanced mainly by the peatbog growth on the areas outside channels. Frequency and rate of avulsion of the river channels influenced the size, continuity and variability of the peatbogs.     

Gelification of victorian tertiary soft brown coal wood. II. Changes in chemical structure associated with variation in the degree of gelification

The gross chemical structures of xylites and gelified soft brown coal woods, Latrobe Valley, Victoria, Australia, as determined by solid state nuclear magnetic resonance spectroscopy, are compared with those of present-day wood-derived materials prepared from an angiosperm, Eucalyptus regnans, and a gymnosperm (conifer), Pinus radiata. Also examined are the changes in the gross chemical structures of soft brown coal woods with increase in their degree of gelification and the relationship between these changes and variations in their chemical composition and microscopic appearance.The Victorian xylites exhibit greater affinities with the present-day gymnosperm than the present-day angiosperm. The progressive removal of cellulose with increasing degree of gelification can be equated with an increase in huminite reflectance, elimination of humotelinite autofluorescence and changes in the relative proportions of the humotelinite submacerals. The lignin structure of xylite is also modified during the gelification process, including the progressive loss of methoxyl groups and evidence of minor oxidation.     

Study of petroleum generation by pyrolysis—I. Pyrolysis experiments by Rock-Eval and assumption of molecular structural change of kerogen using13C-NMR

Green River shale (Type I kerogen), Yaamba shale (Type II kerogen) and Sarufutsu coal (Type III kerogen) were heated to various temperatures using Rock-Eval. The amount of hydrocarbons generated and weight loss by pyrolysis were measured to obtain a better understanding of petroleum generation. After the pyrolysis experiments, elemental analysis (C, H), vitrinite reflectance (%R_o) measurement, maceral observation, infrared spectroscopy (IR) and¹³C-NMR spectroscopy were carried out on the coal samples. Changes in H/C atomic ratio, IR and NMR spectra indicate that experiments by Rock-Eval resemble those of the natural evolution of kerogen. However, the petrographic changes of the coal show more similarity to coal liquefaction and coking than to natural coalification. Changes in the amount of generated hydrocarbons with increasing maturation show that Type II kerogen produces more hydrocarbons than does Type I when R_o does not exceed 1.1%. Petroleum generation curves for the three samples were concordant with trends in natural systems, and a conceptual model of petroleum generation curve classified into three types is proposed, namely (1) curve of total amount enerated, (2) curve of generation rate, and (3) curve of fluid composition. Changes of IR and NMR spectra after pyrolysis imply that generated hydrocarbons are derived from aliphatic C structures of kerogen macromolecules. Moreover, the difference in genetic potential between Type I and Type III reflects different amounts of aliphatic structures. Type I is assumed to have a simple assemblage (mainly polymethylene carbons), and Type III is assumed to have a more complex variety of structures that are responsible for the difference in generation rates between the two kerogen Types. A quantitative analysis of C species of various bond structure by¹³C-NMR confirms that petroleum generation is the process of bond cleavage of kerogen macromolecules; lower-energy bonds decrease at an earlier stage of reaction, while aromatic carbons with higher bond energies survive to form graphitic structure at postmature stages. Emphasis is placed on the idea that the most important and direct factor in petroleum generation is a change in the molecular structure of kerogen with increasing maturation. NMR and other methods providing information about molecular structures of kerogen will become strong tools for evaluating source rocks and sedimentary basins in the future.     

次火山热变质煤的物理测试特征

样品采自伊敏褐煤盆地中一个因次火山活动形成的烟煤区,包含了从褐煤到瘦煤的变质系列。红外光谱分析表明,煤的含氧基团在褐煤阶段已开始消失,烷基和芳环同步增加,在R°=1.10%时达最大值。顺磁共振自由基浓度和X-衍射参数La/Lc介于区域变质煤和岩浆接触热变质煤之间,芳核外官能团的热演化超前于芳核骨架及R°的演化。