劉炯天 朱書全 張明旭 趙躍民 王智化

摘 要：該研究主要開展了以下工作：（1）完成了我國典型低品質(zhì)煤的基本指標(biāo)分析，初步查明典型低品質(zhì)煤中主要成灰礦物、硫和水的賦存特征；初步闡明表面含氧官能團(tuán)和孔隙結(jié)構(gòu)。（2）建立了熱壓褐煤脫水系統(tǒng)平臺、熱水提質(zhì)褐煤裝置，CO2超臨界萃取儀，建立了熱煙氣（氮氣）干燥褐煤的實驗裝置。原理工大學(xué)建立了提質(zhì)褐煤復(fù)吸實驗平臺。在曙光5000A，IBMPOWER755、DELL，寶德等高性能高服務(wù)器上，利用GAUSSIAN09、ADF、MS5.5、VASP、SIESTA等計算軟件，建立了構(gòu)建褐煤脫水的計算模擬平臺。（3）建立了電磁特性分析測試平臺；通過全組分分離、索式萃取分離、XPS、GC/MS等分析方法和手段認(rèn)知了煉焦煤表面結(jié)構(gòu)及有機(jī)硫的分布特征；利用電磁特性測試系統(tǒng)獲取了新峪煉焦煤樣在不同頻率下的復(fù)介電常數(shù)；初步認(rèn)知微波脫硫的最佳頻段；采用Materials Studio 6.0軟件中的DMol3模塊對苯并噻吩和四六二甲基苯并噻吩的結(jié)構(gòu)和性質(zhì)進(jìn)行理論研究。

關(guān)鍵詞：低品質(zhì)煤 賦存特征 電磁特性

Basic Research of Large-scale Quality Improvement and Utilization of Low-quality Coal

Liu Jiongtian1 Zhu Shuquan2 Zhang Mingxu3 Zhao Yuemin1 Wang Zhihua4

（1.China University of Mining and Technology；2.China University of Mining & Technology，Beijing；3.Anhui University Of Science & Technology；

4.Zhejiang University）

Abstract：Since the project was officially launched， the team conduct a large number of studies， combine with expert advice， thus further clarify the research focus， adjust and improve the scheme. As the project goes， constantly and timely adjusting experimental scheme； refine the research process. After the first year of the project construction， improve the research content， form clear research objectives and laid a solid foundation for the project to conduct smoothly and orderly.（1）The team completes the basic indicator analysis of typical low-quality coal， preliminarily discover how the principal forming-ash minerals/sulfur/moisture of the typical low-quality coal exist and clarify surface oxygen functional groups and pore structure.（2）The team establishes a lignite-dewatering system under pressure and high temperature， lignite-upgrading unit through hot water，CO2 supercritical extractor， and lignite-drying in hot flue gas （nitrogen） lab facilities. Taiyuan University of Technology establishes lignite-upgrading relapse experimental platform. we build calculating simulation platform of lignite dehydration based on high performance servers like dawn 5000A， IBMPOWER755、DELL、BAODE etc. and calculation software like GAUSSIAN09、ADF、MS5.5、VASP，SIESTA.（3）The team establishes a platform for testing electromagnetic characteristics. Through its wholly-component separation， Soxhlet extraction， XPS， GC / MS and other methods， we discover the surface structure and distribution of organic sulfur of the coking coal. Obtain the complex permittivity of coking coal samples from Xinyu at different frequencies using electromagnetic characteristics-testing system. Preliminarily discover optimal microwave band for desulfurization， research theoretically the structure and properties of benzothiophene and four- six two methylbenzothiophene using the DMol3 module in Materials Studio 6.0 software. In summary， from January 1， 2012 to October 31， 2012， 83 people participate the project， 1 monograph and 51 papers including 18 SCI and 11 EI and 1are published. 10 important academic conference Plenary Lectures are given. The team apply for 15 invention patents， two are authorized， and train 9 doctors and 21 masters in total.

Key Words：Low-quality coal； Principal forming； Electromagnetic characteristics

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