Selection of fluxing agent for coal ash and investigation of fusion mechanism (Record no. 170185)

MARC details
000 -LEADER
fixed length control field 02111nab a2200193 4500
008 - CÓDIGOS DE INFORMACIÓN DE LONGITUD FIJA - INFORMACIÓN GENERAL
Campo de control de longitud fija 260224s2009 xxu
245 00 - TITULO
Título Selection of fluxing agent for coal ash and investigation of fusion mechanism
Subtítulo A first-principles study
260 ## - PUBLICACION, DISTRIBUCION, ETC
Lugar de publicación, distribución, etc.
Nombre de publicador, distribuidor, etc.
Fecha de publicación, distribución, etc. ene. 2009
270 ## - FECHA DE CARGA
Fecha de carga 24/07/2009 ; 24/07/2009
300 ## - DESCRIPCION FISICA
Otra extensión 5 p. ; 704-709
520 ## - RESUMEN, ETC
Resumen Transcripción del resúmen publicado por el autor: An approach based on the ab initio quantum chemical modeling [CASTEP, generalized gradient approximation (GGA), and density functional theory (DFT)] was first employed to guide the selection of the appropriate fluxing agent to reduce the coal ash melting temperature. Two kinds of typical Chinese coal ash A and B with a high-melting temperature were chosen as the investigated subjects. Result of the calculation shows that mullite mineral, which is the main component of coal ash, is easier to combine with an electron acceptor than with an electron donor. Because the cations of borax (Na2B4O7·10H2O) and limestone can act as electron acceptors, borax and limestone were selected as the fluxing agents in our experiment. Results of the experiment show that the melting temperatures of coal ash A and B are both decreased by borax and limestone, respectively. Moreover, borax has a better fluxing effect than limestone under the same conditions. The further numerical study on the coal ash fusing mechanism indicates that the Na+ and Ca2+ cations, as acceptors, can enter into the crystal lattice of mullite mainly through O(7) and O(8) and then cause the Al(6)-O(8) and Al(5)-O(7) bonds to rupture in the [AlO6]-octahedron. From this, mullite is forced to transform to feldspar and corundum minerals that have a low binding energy. Because of the phase change of minerals in the coal ash, the coal ash melting temperature is decreased by adding borax and limestone.
773 0# - CORRECCIÓN
Título Energy & fuels
Partes relacionadas 23
942 ## - DESC. DE MATERIAL
Tipo de item KOHA Artículo de Revista
100 1# - RESPONSABLE PERSONAL
Apellido, Nombre Li, Jie
9 (RLIN) 41566
100 1# - RESPONSABLE PERSONAL
Apellido, Nombre Du, Mei-Fang
9 (RLIN) 41567
100 1# - RESPONSABLE PERSONAL
Apellido, Nombre Zhang, Zhong-Xiao
9 (RLIN) 41568
Holdings
Biblioteca propietaria Biblioteca actual Fecha de adquisición Inventario Total de préstamos Inventario Fecha de carga Tipo de item KOHA
Biblioteca Alejandro Angel Bulgheroni Biblioteca Alejandro Angel Bulgheroni 05/03/2026 200045012   200045012 05/03/2026 Artículo de Revista


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