An Algorithm for the Determination of All Significant Pathways in Chemical Reaction Systems     

Ralph Lehmann 《Journal of Atmospheric Chemistry》2004,47(1):45-78

When the output of a complex chemical model is analysed, a typical topic isthe determination of pathways, i.e., reaction sequences, that produce ordestroy a chemical species of interest.A representative example is the investigation of catalytic ozone destruction cycles in the stratosphere.An algorithm for the automatic determination of pathways in any given reactionsystem is presented. Under the assumption that reaction rates are known, it finds all significant pathways, i.e., all pathways with a rate above a prescribed threshold.The algorithm forms pathways step by step, starting from single reactions.The chemical species in the system are consecutively considered as `branching points'.For every branching-point species, each pathway producing it is connected witheach pathway consuming it.Rates proportional to `branching probabilities' are calculated.Pathways with a rate that is smaller than a prescribed threshold arediscarded.If a newly formed pathway contains sub-pathways, e.g., null cycles, it is split into these simpler pathways.In order to demonstrate the performance of the algorithm, it has been applied to the determination of catalytic ozone destruction cycles and methaneoxidation pathways in the stratosphere.  相似文献   

鄂尔多斯盆地奥陶系海相碳酸盐岩生烃性能与中部长庆气田气源成因研究   总被引：15，自引：0，他引：15  

刘德汉  付金华  郑聪斌  肖贤明  米敬奎 《地质学报》2004,78(4):542-550

用激光 -荧光显微镜等有机岩石学方法 ,挑选样品中有明显生、排烃现象的碳酸盐岩 ,再以测定的这类碳酸盐岩的有机碳含量为依据 ,确定本区高成熟碳酸盐气源岩残余有机碳的下限指标用 0 .13%～ 0 .14 %比较合理。根据碳酸盐岩储层孔隙中充填沥青和皮膜状残余沥青的分布和含量 ,论证了陕参 1井等奥陶系碳酸盐岩地层在地质历史中 ,存在若干油气有效储层。采用连续升温 ,步进取样的热模拟实验方法 ,揭示了本区煤与碳酸盐岩干酪根随热演化作用增强 ,烃类气体产物的干燥系数增大 ,δ1 3C1 、δ1 3C2 明显变重的规律 ,并根据样品实验结果推算 ,本区石炭系—二叠系煤最大生气阶段的δ1 3C1 应为 - 2 7‰～ - 2 8‰ ,碳酸盐岩最大生气阶段的δ1 3C1 应为- 31.7‰～ - 33‰。在气源成因判识中 ,根据主生气期阶段对天然气成藏储聚的贡献最大、甲烷碳同位素较重以及长庆气田风化壳气藏天然气δ1 3C1 重值区并不与石炭系—二叠系煤的镜质组反射率高值区匹配的现象等进行气源判识 ,认为长庆奥陶系风化壳气藏 ,具有下古生界海相碳酸盐岩气与上古生界石炭系—二叠系煤成气的混源成因  相似文献   

Differential retardation of organic matter maturation by overpressure   总被引：2，自引：1，他引：2  

HAO Fang    JIANG Jianqun  ZOU Huayao  FANG Yong & ZENG Zhiping . Key Lab for Hydrocarbon Accumulation Mechanism in the Ministry of Education  Petroleum University  Beijing  China  . Department of Petroleum Geology  China University of Geosciences  Wuhan  China 《中国科学D辑(英文版)》2004,47(9)

Thetraditionalhydrocarbongenerationmodeldoesnottakeintoaccounttheeffectofpressure[1].Astotheroleofpressureinorganicmattermaturationandpetroleumgeneration,threeconflictingopinionshaveeverbeenproposed:(1)Increasingpressurehasnodetectableeffectonorganic-mattermaturation[1,2];(2)increasingpressureenhanceshydrocarbon-thermaldestruction[3];(3)increasingpressuresignificantlyretardsorganic-mattermaturationandhydrocarbongeneration[4,5].Therearemorethan180overpressuredbasinsintheworld.Theroleofoverpress…  相似文献   

Accuracy analysis, dem generation and validation using russian tk-350 stereo-images     

Gürcan Büyüksalih  Güven Koçak  Murat Oruç  Hakan Akçin  Karsten Jacobsen 《The Photogrammetric Record》2004,19(107):200-218

TK-350 stereo-scenes of the Zonguldak testfield in the north-west of Turkey have been analysed. The imagery had a base-to-height ratio of 0·52 and covered an area of 200 km × 300 km, with each pixel representing 10 m on the ground. Control points digitised from 1:25 000 scale topographic maps were used in the test. A bundle orientation was executed using the University of Hanover program BLUH and PCI Geomatica OrthoEngine AE software packages. Tests revealed that TK-350 stereo-images can yield 3D geopositioning to an accuracy of about 10 m in planimetry and 17 m in height. A 40 m resolution digital elevation model (DEM) was generated by the PCI system and compared against a reference DEM, which was derived from digitised contour lines provided by 1:25 000 scale topographic maps. This comparison showed that accuracy depends mainly on the surface structure and the slope of the local terrain. Root mean square errors in height were found to be about 27 and 39 m outside and inside forested areas, respectively. The matched DEM demonstrated a systematic shift against the reference DEM visible as an asymmetric shift in the frequency distribution. This is perhaps caused by the presence of vegetation and buildings.  相似文献   

潜水面变动的空间四面体单元网格自动生成方法          下载免费PDF全文

成建梅  黄丹红  胡进武 《水科学进展》2004,15(3):276-279

提出了一种由平面三角网格自动生成三维空间四面体单元网格的方法,其基本思路是将含水层平面分成三角形单元网格,将每个三角形沿垂直方向对应一个三棱柱,作为最初的三棱柱;依次将每个三棱柱按照潜水面位置和分层信息划分成不同数目的四面体,从而生成三维空间四面体单元网格。剖分结果表明,此方法综合考虑了潜水面的位置和各含水层顶底板的起伏情况,能够简洁地生成层面起伏的空间四面体网格,特别适用于刻画潜水面波动、含水层顶底板起伏和存在透镜体或岩性缺失等含水层结构复杂的情况下,自动地剖分并生成单元信息,为三维计算的实现奠定了基础。  相似文献   

闽东北地区夏季对流云特征的初步分析     

左平昭  陈秋萍  郭正明  陈德汶  刘锐志 《气象科技》2005,(Z1)

利用新一代天气雷达资料分析闽东北地区夏季对流云的回波特征。分析表明:多单体合并对流云在生命史、回波高度、强度、尺度等方面都超过了单体对流云,其液态水总量也更大,自然降水条件和人工影响潜力都优于单体对流云,是夏季降水和人工催化的重要云系。分析得到对流云发展的不同阶段、不同高度层辐合辐散特点,为进一步研究夏季对流云结构和降水原理提供科学依据。通过对两个个例的天气形势分析,指出冷空气对对流发展有一定的激发作用。  相似文献   

Magma generation and crustal accretion as evidenced by supra-subduction ophiolites of the Albanide–Hellenide Subpelagonian zone     

Luigi  Beccaluva  Massimo  Coltorti  Emilio  Saccani  Franca  Siena 《Island Arc》2005,14(4):551-563

Abstract Ophiolites of the Mirdita–Subpelagonian zone form a nearly continuous belt in the Albanide–Hellenide orogen, including mid‐ocean ridge basalt (MORB) associations in the western Mirdita sector and supra‐subduction zone (SSZ) complexes, with prevalent island arc tholeiitic (IAT) and minor boninitic affinities in the eastern part of the belt (i.e. eastern Mirdita, Pindos, Vourinos). In addition, basalts with geochemical features intermediate between MORB and IAT (MORB/IAT) are found in the central Mirdita and in the Aspropotamos sequence (Pindos). These basalts alternate with pure MORB and are cut by boninitic dykes. The distinctive compositional characteristics of the mafic magmas parental to the different ophiolitic suites can be accounted for by partial melting of mantle sources progressively depleted by melt extractions. Partial melting processes (10–20%) of lherzolitic sources generated pure MORB, leaving clinopyroxene‐poor lherzolite as a residuum. Approximately 10% water‐assisted partial melting of this latter source, in an SSZ setting, may in turn generate basalts with MORB/IAT intermediate characteristics, whereas IAT basalts and boninites may have been derived from 10–20% and 30% partial melting, respectively, of the same source variably enriched by subduction‐derived fluids. In addition, boninites may also have been derived by comparatively lower degrees of hydrated partial melting of more refractory harzburgitic sources. A generalized petrologic model based on mass balance calculations between bulk rock and mineral compositions, indicate that most of the intrusives (from ultramafic cumulates to gabbronorites and plagiogranites), as well as sheeted dykes and volcanics (from basalts to rhyodacites) forming the bulk crustal section of the SSZ ophiolites, may be accounted for by shallow fractional crystallization from low‐Ti picritic parental magmas very similar in composition to IAT picrites from Pacific intraoceanic arcs. The most appropriate tectono‐magmatic model for the generation of the SSZ Tethyan ophiolites implies low velocity plate‐convergence of the intraoceanic subduction and generation of a nascent arc with IAT affinity and progressive slab roll‐back, mantle diapirism and extension from the arc axis to the forearc region, with generation of MORB/IAT intermediate basalts and boninitic magmas.  相似文献   

玄武岩浆起源和演化的一些基本概念以及对中国东部中-新生代基性火山岩成因的新思路   总被引：44，自引：3，他引：44  

牛耀龄 《高校地质学报》2005,11(1):9-46

以全球大地构造为背景讨论了玄武岩浆起源和演化的一些基本概念.这些概念的正确理解有助于合理解释各种环境中火成岩的形成机制,也有助于依据野外岩石组合来判别古构造环境.在此基础上结合已有资料和观察,对中国东部中生代岩石圈减薄及中-新生代基性火山岩成因提出了一些新解释.这些解释与地质观察相吻合,且符合基本的物理学原理.虽然中国东部基性火山活动可称为"板内"火山活动,但它实际上是板块构造的特殊产物.中国东部中生代岩石圈减薄是其下部被改造为软流层的缘故.这种改造是加水"软化"所致.水则源于中国东部地幔过渡带(410～660 km)内古太平洋(或其前身)俯冲板块脱水作用.其将岩石圈底部改造为软流层的过程,实际上就是岩石圈减薄的过程.因为软流层是地幔对流的重要部分,而大陆岩石圈则不直接参与地幔对流.中生代玄武岩具有εNd＜0的特征,说明其源于新近改造而成的软流层,亦即原古老岩石圈之底部.中国大陆北北东-南南西向的海拔梯度突变界线与东-西部重力异常,陆壳厚度变化,以及地幔地震波速变化梯度吻合.因此可将北北东-南南西向梯度线称为"东-西梯度界".该界东-西海拔高差(西部高原与东部丘陵平原),陆壳厚度差异(西部厚而东部薄)和100～150 km的深度范围地幔地震波速差异(西部快而东部慢),均受控于上地幔重力均衡原理.这表明西部高原岩石圈厚度＞150～200 km,而东部丘陵平原岩石圈厚度＜80km."遥远"的西太平洋俯冲带具有自然的地幔楔吸引作用.此吸引作用可引起中国东部"新生"软流层东流.软流层东流必将引起西部高原底部软流层的东向补给(流动).这一过程必然导致东移软流层的减压,即从西部的深源(岩石圈深度＞150～200 km处)到东部的浅源(岩石圈深度～80km处).东移软流层的减压分熔可合理解释具有软流圈地球化学特征(εNd＞0)的新生代中国东部基性火山活动及玄武岩的成因.这些对中国东部中-新生代地质过程的解释,将为更加细致的,以岩石学和地球化学为主的讨论所验证.  相似文献   

Continuous Gradations among Primary Carbonatitic, Kimberlitic, Melilititic, Basaltic, Picritic, and Komatiitic Melts in Equilibrium with Garnet Lherzolite at 3-8 GPa   总被引：3，自引：0，他引：3  

GUDFINNSSON  GUDMUNDUR H.; PRESNALL  DEAN C. 《Journal of Petrology》2005,46(8):1645-1659

Multianvil melting experiments in the system CaO–MgO–Al₂O₃–SiO₂–CO₂(CMAS–CO₂) at 3–8 GPa, 1340–1800°C, involvingthe garnet lherzolite phase assemblage in equilibrium with CO₂-bearingmelts, yield continuous gradations in melt composition betweencarbonatite, kimberlite, melilitite, komatiite, picrite, andbasalt melts. The phase relations encompass a divariant surfacein P–T space. Comparison of the carbonatitic melts producedat the low-temperature side of this surface with naturally occurringcarbonatites indicates that natural magnesiocarbonatites couldbe generated over a wide range of pressures >2·5 GPa.Melts analogous to kimberlites form at higher temperatures alongthe divariant surface, which suggests that kimberlite genesisrequires more elevated geotherms. However, the amount of waterfound in some kimberlites has the potential to lower temperaturesfor the generation of kimberlitic melts by up to 150°C,provided no hydrous phases are present. Compositions resemblinggroup IB and IA kimberlites are produced at pressures around5–6 GPa and 10 GPa, respectively, whereas the compositionsof some other kimberlites suggest generation at higher pressuresstill. At pressures <4 GPa, an elevated geotherm producesmelilitite-like melt in the CMAS–CO₂ system rather thankimberlite. Even when a relatively CO₂-rich mantle compositioncontaining 0·15 wt % CO₂ is assumed, kimberlites andmelilitites are produced by <1% melting and carbonatitesare generated by even smaller degrees of melting of <0·5%. KEY WORDS: carbonatite; CO₂; kimberlite; melilitite; melt generation  相似文献   

黄土区人类活动影响下的 产汇流模拟研究   总被引：4，自引：0，他引：4  

池宸星  郝振纯  王玲  胡健伟 《地理科学进展》2005,24(3):101-108

日益频繁的人类活动改变了流域下垫面条件,对流域产汇流产生很大的影响。本文以黄河中游典型支流岔巴沟为研究区域,提出利用基于DEM的分布式水文模拟技术,探讨流域人类活动过程中的产汇流模拟,避免了经验公式的概化和由此引起的局限。模拟的结果证实了该方法的可行性。采用网格滞蓄的方法可以在子网格上体现人类活动引起的下垫面的变化及其对产汇流的影响,反映各个时期的产汇流条件,对降雨做出合理响应。  相似文献