The high-carbon ferrochrome is an essential raw material for producing stainless steel,and the demand of it increases with the increase of stainless steel.So increasing Cr recovery rate from chromite is essential for ...The high-carbon ferrochrome is an essential raw material for producing stainless steel,and the demand of it increases with the increase of stainless steel.So increasing Cr recovery rate from chromite is essential for lower costs and higher economic benefits in high-carbon ferrochrome production process.This study calculated the activity of CrO_(x)in slag and investigated the distribution behavior of Cr between slag and alloy.Theω(MgO)/ω(Al_(2)O_(3))was 1.0,and the w(CaO)/w(SiO_(2))was from 0.2 to 0.6 in this study.The calculation and experimental results showed that the main phases of the slag were chrome-containing spinel,magnesium-aluminum spinel,olivine and melilite.The content of spinel in slag decreased with the increasing w(CaO)/w(SiO_(2)),and the w(CrO_(x))in spinel also reduced,but the content of melilite increased.The distribution ratio of Cr between slag and alloy decreased with the increase of slag basicity at 1600℃,meansning that increasing the w(CaO)/w(SiO_(2))of slag can improve the recovery of Cr in chromite smelting process.展开更多
β-Ga_(2)O_(3)以其较高的导带底(Conduction Band Minimum,CBM)和较低的价带顶(Valence Band Maximum,VBM),赋予其光生电子和空穴较强的还原与氧化能力,但其宽禁带和高载流子复合率限制了在光催化中的应用.金属离子掺杂被认为是提升光...β-Ga_(2)O_(3)以其较高的导带底(Conduction Band Minimum,CBM)和较低的价带顶(Valence Band Maximum,VBM),赋予其光生电子和空穴较强的还原与氧化能力,但其宽禁带和高载流子复合率限制了在光催化中的应用.金属离子掺杂被认为是提升光催化性能的有效途径.本文基于第一性原理系统研究了Sr、Ba、V、Nb、Ta等二十种元素掺杂对β-Ga_(2)O_(3)光催化性能的影响,研究发现:Sr、Nb、Ta、Mn、Fe、Zn、Hg七种元素掺杂β-Ga_(2)O_(3)后,材料除能保持合适的带边位置外,还具有更高的电子空穴分离效率以及更低的形成能,表明这些元素的引入可有效提升β-Ga_(2)O_(3)光催化效率;Nb、Ta掺杂可显著增强材料在红外光区的吸收,Mn、Fe掺杂则显著提升材料在紫外和可见光区的吸收能力,其中,Nb在0.5 eV处光吸收系数高达1.38×10^(5)cm^(−1),Mn、Fe掺杂在3 eV处光吸收系数可达1×10^(5)cm^(−1),在不同波段均呈现出良好的光吸收能力.此外,Hg掺杂表现出跨红外至深紫外的宽波段增强效果,Hg掺杂后,电子空穴相对有效质量高达109,说明Hg掺杂显著提升载流子分离能力,同时由于其在宽波段显著增强的光吸收效果,因此,Hg可作为β-Ga_(2)O_(3)在光催化制氢中理想的金属掺杂元素,以上研究结果为β-Ga_(2)O_(3)光催化分解水制氢研究提供了价值参考.展开更多
基金Project(2023XQLH055)supported by Central South University Graduate Research Innovation Project(University-Enterprise Joint Project),China。
文摘The high-carbon ferrochrome is an essential raw material for producing stainless steel,and the demand of it increases with the increase of stainless steel.So increasing Cr recovery rate from chromite is essential for lower costs and higher economic benefits in high-carbon ferrochrome production process.This study calculated the activity of CrO_(x)in slag and investigated the distribution behavior of Cr between slag and alloy.Theω(MgO)/ω(Al_(2)O_(3))was 1.0,and the w(CaO)/w(SiO_(2))was from 0.2 to 0.6 in this study.The calculation and experimental results showed that the main phases of the slag were chrome-containing spinel,magnesium-aluminum spinel,olivine and melilite.The content of spinel in slag decreased with the increasing w(CaO)/w(SiO_(2)),and the w(CrO_(x))in spinel also reduced,but the content of melilite increased.The distribution ratio of Cr between slag and alloy decreased with the increase of slag basicity at 1600℃,meansning that increasing the w(CaO)/w(SiO_(2))of slag can improve the recovery of Cr in chromite smelting process.
文摘β-Ga_(2)O_(3)以其较高的导带底(Conduction Band Minimum,CBM)和较低的价带顶(Valence Band Maximum,VBM),赋予其光生电子和空穴较强的还原与氧化能力,但其宽禁带和高载流子复合率限制了在光催化中的应用.金属离子掺杂被认为是提升光催化性能的有效途径.本文基于第一性原理系统研究了Sr、Ba、V、Nb、Ta等二十种元素掺杂对β-Ga_(2)O_(3)光催化性能的影响,研究发现:Sr、Nb、Ta、Mn、Fe、Zn、Hg七种元素掺杂β-Ga_(2)O_(3)后,材料除能保持合适的带边位置外,还具有更高的电子空穴分离效率以及更低的形成能,表明这些元素的引入可有效提升β-Ga_(2)O_(3)光催化效率;Nb、Ta掺杂可显著增强材料在红外光区的吸收,Mn、Fe掺杂则显著提升材料在紫外和可见光区的吸收能力,其中,Nb在0.5 eV处光吸收系数高达1.38×10^(5)cm^(−1),Mn、Fe掺杂在3 eV处光吸收系数可达1×10^(5)cm^(−1),在不同波段均呈现出良好的光吸收能力.此外,Hg掺杂表现出跨红外至深紫外的宽波段增强效果,Hg掺杂后,电子空穴相对有效质量高达109,说明Hg掺杂显著提升载流子分离能力,同时由于其在宽波段显著增强的光吸收效果,因此,Hg可作为β-Ga_(2)O_(3)在光催化制氢中理想的金属掺杂元素,以上研究结果为β-Ga_(2)O_(3)光催化分解水制氢研究提供了价值参考.
