降文萍，张群，崔永君 . 煤吸附气体的量子化学特性及其应用[J]. 天然气地球科学, 2014 , 25(3) : 444 -452 . DOI: 10.11764/j.issn.1672-1926.2014.03.444

［1］Gas Research Institute.A guide to Coalbed Methane Reservoir Engineering［M］.Chicago:Gas Research Institute,1994.

［2］Zhang Xinmin,Zhang Suian,Zhong Lingwen,et al.Coalbed Methane in China［M］.Xi′an:Shaanxi Science and Technology Press,1991.［张新民,张遂安,钟玲文,等.中国的煤层CH4［M］.西安:陕西科学技术出版社,1991.］

［3］Zhang Qun,Yang Xilu.Isothermal adsorption of coals on methane under equilibrium moisture［J］.Journal of China Coal Society,1999,24(6):566-570.［张群,杨锡禄.平衡水分条件下煤对CH₄的等温吸附特性研究［J］.煤炭学报,1999,24(6):566-570.］

［4］Zhang Xinmin,Zhao Jingzhou.China Coalbed Methane Technically Recoverable Resource Potential［M］.Beijing:Science Press,2010.［张新民,赵靖舟.中国煤层气技术可采资源潜力［M］.北京:科学出版社,2010.］

［5］Zhao Zhigen,Tang Xiuyi.Discussion about Langmuir equation concerning methane adsorption by coal［J］.Journal of Jiaozuo Institute of Technology:Natural Science Edition,2002,21(1):1-4.［赵志根,唐修义.对煤吸附CH₄的Langmuir方程的讨论［J］.焦作工学院学报:自然科学版,2002,21(1):1-4.］

［6］Laxrninarayana C H,Crosdale P J.Modeling Methane Adsorption Isotherms Using Pore Filling Models:A Case Study on India Coals［C］.Intemational Coalbed Methane Symposium,1999:117-128.

［7］Mahmud S.A Generalized Ono-kondo Lattice Model for High Pressure Adsorption［D］.USA-Stillwater:Master of Science Oklahoma State University,2003:1-188.

［8］Collins R E.New Theory for Gas Adsorption and Transport in Coal［C］.International Coalbed Methane Symposium,1991:525-531.

［9］Chen Changguo,Xian Xiaohong,Zhang Daijun,et al.The volume filling theory of the adsorption of methane on anthracite and its char［J］.Journal of Chongqing University:Natural Science Edition,1998,21(2):75-79.［陈昌国,鲜晓红,张代钧，等.微孔填充理论研究无烟煤和炭对CH₄的吸附特性［J］.重庆大学学报:自然科学版,1998,21 (2):75-79.］

［10］Zhang Qun,Cui Yongjun,Zhong Lingwen,et al.Temperature-pressure comprehensive adsorption model for coal adsorption of methane［J］.Journal of China Coal Society,2008,33(11):1272-1278.［张群,崔永君,钟玲文,等.煤吸附CH₄的温度—压力综合吸附模型［J］.煤炭学报,2008,33(11):1272-1278.］

［11］Yu Hongguan,Fan Weitang,Sun Maoyuan,et al.Study on fitting models for methane isotherms adsorption of coals［J］.Journal of China Coal Society,2004,29(4):463-467.［于洪观,范维唐,孙茂远,等.煤中CH4等温吸附模型的研究［J］.煤炭学报,2004,29(4):463-467.］

［12］Fitzgerald J E,Sudibnadriyo M,Robinson R L,et al.Modeling the adsorption of pure gases on coals with the SLD model［J］.Carbon,2003,41:2203-2216.

［13］Dai Shifeng,Zhang Beibei,Peng Suping,et al.Models of pure CO₂ and pure CH₄adsorption on the Late Paleozoic coals from the Kailuan coal field,Hebei［J］.Acta Geologica Sinica,2009,83(5):731-737.［代世峰,张贝贝,彭苏萍,等.河北开滦矿区晚古生代煤对CO₂和CH₄气体吸附模型探讨［J］.地质学报,2009,83(5):731-737.］

［14］Jiang Wenping,Cui Yongjun,Zhong Lingwen,et al.The quantum chemical study on the coal surface interacting with CH₄ and H₂O［J］.Natural Gas Geoscience,2007,18(4):576-579.［降文萍,崔永君,钟玲文,等.煤中水分对煤吸附CH₄影响机理的理论研究［J］.天然气地球科学,2007,18(4):576-579.］

［15］Zhao Jin,Zhang Suian,Cao Lihu.Comparison of experimental adsorption between shale gas and coal bed gas［J］.Natural Gas Geoscience,2013,24(1):176-181.［赵金,张遂安,曹立虎.页岩气与煤层气吸附特征对比实验研究［J］.天然气地球科学,2013,24(1):176-181.］

［16］Chen Changguo,Wei Xiwen,Xian Xuefu.Research on interaction of coal surface and methane molecule by abinitio calculation［J］.Journal of Chongqing University,2000,23(3):77-83.［陈昌国,魏锡文,鲜学福.用从头计算研究煤表面与CH4分子相互作用［J］.重庆大学学报,2000,23(3):77-83.］

［17］Debore J H.Dynamic Characteristics of Adsorption［M］.Liu Zhenghui,Wang Guoting,Yang Kongzhang.Translation.Beijing:Science Press,1964:109.［德波尔 J H.吸附的动力学特性［M］.柳正辉,王国庭,杨孔章,译.北京:科学出版社,1964:109.］

［18］Xue Weidong,Zhang Guangfeng,Zhu Zhenghe,et al.Calculation on weakly bound carbon dioxide dimer by DFT［J］.Acta Physico-Chimica Sinica,2001,17(6):501-506.［薛卫东,张广丰,朱正和,等.CO₂二聚体分子弱结合作用的DFT计算［J］.物理化学学报,2001,17(6):501-506.］