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Coexistence Theory of Slag Structure and Its Application to Calculation of Oxidizing Capability of Slag Melts 被引量:29
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作者 ZHANG Jian 《Journal of Iron and Steel Research International》 SCIE EI CAS CSCD 2003年第1期1-10,共10页
The coexistence theory of slag structure and it's application to calculation of the oxidizing capabilities of slag melts is described. It is shown that the law of mass action can be widely applied to the calculati... The coexistence theory of slag structure and it's application to calculation of the oxidizing capabilities of slag melts is described. It is shown that the law of mass action can be widely applied to the calculation of oxidizing capabilities of slag melts in combination with the coexistence theory of slag structure.For slag melts containing basic oxides FeO and MnO, their oxidizing capabilities can be expressed by N Fe tO =N FeO +6N Fe 2O 3 , while for slag melts containing basic oxides CaO, MgO, etc., in addition to FeO and MnO, their oxidizing capabilities can be given as N Fe tO =N FeO +6N Fe 2O 3 +8N Fe 3O 4 . 展开更多
关键词 oxidizing capability coexistence theory slag structure ACTIVITY mass action concentration
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Application of the annexation principle to the thermodynamic property study of ternary metallic melts In-Bi-Cu and In-Sb-Cu 被引量:10
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作者 Man ZhangMetallurgy School, University of Science and Technology Beijing, Beijing 100083, China (Received 2001-10-27) 《Journal of University of Science and Technology Beijing》 CSCD 2002年第3期170-176,共7页
Based on the phase diagrams, measured activities and the annexationprinciple, calculating models of mass action concentrations for In-Bi-Cu and In-Sb-Cu melts havebeen formulated. Calculated results not only agree wel... Based on the phase diagrams, measured activities and the annexationprinciple, calculating models of mass action concentrations for In-Bi-Cu and In-Sb-Cu melts havebeen formulated. Calculated results not only agree well with practical values, but also obey themass action law, showing that the deduced model can reflect the structural reality of given meltasand that the annexation principles is applicable to these tow ternary metallic melts. So long asthere is one from three binary systems constituting the ternary melts, in which the activities ofone component exhibit positive deviation relative to Raoultian behavior, heterogeous meltsinevitably would form, so heterogeneous calculating model should be used to calculate their massaction concentrations. On the contrary, if all the binary melts are homogeneous and their activitiesexhibit negative deviation with respect to the Raoult's law, then the ternary melts formed fromthem will certainly be homogeneous, hence single phase model should be applied. 展开更多
关键词 activity mass action concentration coexistence theory annexationprinciple
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CaO-Al_2O_3-SiO_2熔渣的作用浓度计算模型 被引量:10
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作者 张鉴 袁伟霞 《北京科技大学学报》 EI CAS CSCD 北大核心 1995年第5期418-423,438,共7页
根据相图和炉渣结构的共存理论,推导了CaO-Al2O3-SiO2渣系作用浓度的计算模型,计算的NCaO和NSiO2与相应的实测αCaO和αSiO2基本符合,从而证明所得模型可以反映本渣系的结构本质。与此同时,还发现生... 根据相图和炉渣结构的共存理论,推导了CaO-Al2O3-SiO2渣系作用浓度的计算模型,计算的NCaO和NSiO2与相应的实测αCaO和αSiO2基本符合,从而证明所得模型可以反映本渣系的结构本质。与此同时,还发现生成正硅酸盐(2CaO·SiO2)的碱度因Al2O3的增加而变大的事实和本渣系有∑n较小的活跃部分。 展开更多
关键词 活度 共存理论 作用浓度 碱度 相图 溶渣
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Application of annexation principle to the study of thermodynamic properties of ternary molten salts CaCl_2-MgC_2-NaCl 被引量:8
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作者 ZHANGJian 《Rare Metals》 SCIE EI CAS CSCD 2004年第3期209-213,共5页
Based on the practical basis of measured activities and phase diagrams aswell as in the light of the mass action law. the model of inseparable cations and anions of moltensalts and mattes, and the annexation principle... Based on the practical basis of measured activities and phase diagrams aswell as in the light of the mass action law. the model of inseparable cations and anions of moltensalts and mattes, and the annexation principle of two kinds of solutions in binary melts, thecalculating model of mass action concentrations of molten salts CaCl_2-MgCl_2-NaCl was formulated.The results of calculation not only agree with experimental values, but also obey the mass actionlaw, testifying that the model formulated can embody the structural characteristics of these ternarysalts, and that the model of inseparable cations and anions as well as the annexation principle oftwo kinds of solutions in binary melts are also applicable to these ternary salts. 展开更多
关键词 activity mass action law mass action concentration molten salts
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Calculating models of mass action concentrations for NaBr(aq), LiNO_3(aq), HNO_3(aq), and KF(aq) binary solutions 被引量:8
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作者 Hanjie Guo Weijie Zhao Xuemin Yang 《Journal of University of Science and Technology Beijing》 CSCD 2007年第3期204-211,共8页
The calculating models of mass action concentrations for electrolyte aqueous solutions NaBr-H2O, LiNO3-H2O, HNO3-H2O, and KF-H2O have been developed at 298.15 K and their molalities ranging from 0.1 mol/kg to saturati... The calculating models of mass action concentrations for electrolyte aqueous solutions NaBr-H2O, LiNO3-H2O, HNO3-H2O, and KF-H2O have been developed at 298.15 K and their molalities ranging from 0.1 mol/kg to saturation according to the ion and molecule coexistence theory as well as mass action law. The calculated mass action concentration is based on pure species as the standard state and the mole fraction as the concentration unit, and the reported activities are usually based on infinite dilution as the standard state and molality as the concentration unit. Hence, the calculated mass action concentration must be transformed to the same standard state and concentration unit. The transformation coefficients between calculated mass action concentrations and reported activities of the same component fluctuate in a very narrow range. Thus, the transformed mass action concentrations not only agree well with reported activities, but also strictly obey mass action law. The calculated results show that the new developed models can embody the intrinsic structure of investigated four electrolyte aqueous solutions. The results also indicate that mass action law has its widespread applicability to electrolyte binary aqueous solutions. 展开更多
关键词 mass action concentration ACTIVITY mass action law electrolyte aqueous solution
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二元金属熔体热力学性质按相图的分类 被引量:9
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作者 张鉴 《金属学报》 SCIE EI CAS CSCD 北大核心 1998年第1期75-85,共11页
经过对二元金属熔体的热力学性质结合相图进行研究后,发现将其热力学性质按相图分为含化合物、含包晶体、含饱和相、含固溶体、含共晶体和含连续固溶体六类制定计算模型时,前五类所得作用浓度符合质量作用定理,第六类符合Raoult定律.
关键词 金属熔体 相图 共存理论 作用浓度 金属热力学
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基于共存理论的二元系强电解质水溶液质量作用浓度通用热力学模型 被引量:10
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作者 郭汉杰 赵伟洁 +1 位作者 李林 杨学民 《过程工程学报》 CAS CSCD 北大核心 2007年第2期347-353,共7页
利用离子-分子共存理论建立了可计算强电解质水溶液组元质量作用浓度的热力学通用模型.以KCl-H_2O, CsCl-H_2O,Nacl-H_2O及BaCl_2-H_2O二元系为示例,计算了上述4个二元系在温度为298.15 K、质量摩尔浓度在0.2 mol/kg到饱和浓度范围... 利用离子-分子共存理论建立了可计算强电解质水溶液组元质量作用浓度的热力学通用模型.以KCl-H_2O, CsCl-H_2O,Nacl-H_2O及BaCl_2-H_2O二元系为示例,计算了上述4个二元系在温度为298.15 K、质量摩尔浓度在0.2 mol/kg到饱和浓度范围内的组元质量作用浓度.热力学模型计算的以纯物质为标准态、以摩尔分数为浓度单位的组元质量作用浓度经过转换后,与文献报道的以无限稀为标准态、以质量摩尔浓度为浓度单位的组元活度可良好吻合.这说明本工作建立的强电解质水溶液的质量作用浓度热力学模型可用于预测组元活度,基于强电解质水溶液中存在离子和分子结构的推断是合理的,质量作用浓度在计算的组元浓度范围内遵守质量作用定律. 展开更多
关键词 质量作用浓度 活度 电解质溶液 共存理论 转换系数
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Applicability of mass action law to sulphur distribution between slag melts and liquid iron 被引量:8
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作者 Jian Zhang Metallurgy School, University of Science and Technology Beijing, Beijing 100083, China 《Journal of University of Science and Technology Beijing》 CSCD 2002年第2期90-98,共9页
According to the mass action law and the coexistence theory of slagstructure, the calculating models of mass action concentration for CaO-MgO-FeO-Fe_2O_3-SiO_2,CaO-MgO-MnO-FeO-Fe_2O_3-P_2O_5-SiO_2 and CaO-MgO-MnO-FeO-... According to the mass action law and the coexistence theory of slagstructure, the calculating models of mass action concentration for CaO-MgO-FeO-Fe_2O_3-SiO_2,CaO-MgO-MnO-FeO-Fe_2O_3-P_2O_5-SiO_2 and CaO-MgO-MnO-FeO-Fe_2O_3-Al_2O_3-P_2O_5-SiO_2 slag melts areformulated and sulphur distribution between the slag melts and liquid iron is treated. It is foundthat CaO, MnO and FeO promote desulphurization, while MgO is detrimental to desulphurization. Inaddition, the sulphur distribution coefficients between the slag melts and liquid iron andpresented. 展开更多
关键词 mass action law coexistence theory of slag structure activity massaction concentration
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Calculating model of mass action concentrations for Ag-Au-Cu melts 被引量:4
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作者 ZHANG Jian Metallurgy School, University of Science and Technology Beijing, Beijing 100083, China 《Rare Metals》 SCIE EI CAS CSCD 2002年第1期43-47,共5页
Based on phase diagrams and measured activities, the calculatingmodel of mass action concentrations for het- erogeneous meltsAg-Au-Cu was formulated. Calculated results agree with the improvedresults of recent researc... Based on phase diagrams and measured activities, the calculatingmodel of mass action concentrations for het- erogeneous meltsAg-Au-Cu was formulated. Calculated results agree with the improvedresults of recent research work, Showing that the model formulatedcan reflect the structural characteristics of these melts. In thismodel, without the help Of any empirical parameters, only threeequilibrium constants are used, hence it is simple, lear, andfavorable to the sim- Plification of calculation. 展开更多
关键词 ACTIVITY mass action concentration EUTECTIC Solid solution
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Universal thermodynamic model of calculating the mass action concentrations of omponents in a ternary strong electrolyte aqueous solution and its application in the NaCl-KCl-H_2O system 被引量:5
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作者 Weijie Zhao Hanjie Guo +1 位作者 Xuemin Yang Zhigang Dan 《Journal of University of Science and Technology Beijing》 CSCD 2008年第5期543-551,共9页
A universal thermodynamic model of calculating the mass action concentrations of components in a ternary strong electrolyte aqueous solution has been developed based on the ion and molecule coexistence theory,and veri... A universal thermodynamic model of calculating the mass action concentrations of components in a ternary strong electrolyte aqueous solution has been developed based on the ion and molecule coexistence theory,and verified in the NaCl-KCl-H2O ternary system at 298.15 K. To compare the difference of the thermodynamic model in binary and ternary strong electrolyte aqueous solutions,the mass action concentrations of components in the NaCl-H2O binary strong electrolyte aqueous solution were also computed at 298.15K. A transformation coefficient was required to compare the calculated mass action concentration and reported activity because they were obtained at different standard states and concentration units. The results show that the transformation coefficients between calculated mass action concentrations and reported activities of the same components change in a very narrow range. The calculated mass action concentrations of components in the NaCl-H2O and NaCl-KCl-H2O systems are in good agreement with the reported activities. This indicates that the developed thermodynamic model can reflect the structural characteristics of solutions,and the mass action concentration also strictly follows the mass action law. 展开更多
关键词 mass action concentration activity ternary system binary system ion and molecule coexistence theory transformation coefficient
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Effect of Basicity on Deoxidation Capability of Refining Slag 被引量:5
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作者 DENG Zhi-yin ZHU Miao-yong +1 位作者 ZHONG Bao-jun DAI Yong-gang 《Journal of Iron and Steel Research International》 SCIE EI CAS CSCD 2013年第2期21-26,共6页
Mass action concentration (activity) calculation model was used to analyze the variation rule of mass action concentrations of slag compositions with basicity changing, and the effect of basicity on deoxidation capa... Mass action concentration (activity) calculation model was used to analyze the variation rule of mass action concentrations of slag compositions with basicity changing, and the effect of basicity on deoxidation capability and control of spinel and globular inclusions was investigated theoretically. From the calculation and experimental results, it was found that with the increase of basicity, the mass action concentration of Al2O3 and SiO2 decreases, while the mass action concentration of FeO and MgO increases at first and then decreases.Slag basicity below 3 to 4 would help to control spinel inclusions formation, and higher basicity improves formation of globular inclusions. Slag with basicity under 2 can effectively control the formation of globular inclusions. Deoxidation capability of slag increases with the increase of basicity, and slag with basicity about 4 could almost reach the maximum deoxidation capability. In order to smelt low oxygen steel with globular inclusions controlled, refining slag basicity should be controlled at about 4. 展开更多
关键词 DEOXIDATION mass action concentration ACTIVITY BASICITY INCLUSION
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基于IMCT理论的CaO-SiO_2-MgO-Al_2O_3-Na_2O渣系的脱硫热力学模型 被引量:6
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作者 雷家柳 赵栋楠 +1 位作者 朱航宇 蒋跃东 《钢铁》 CAS CSCD 北大核心 2019年第3期35-41,共7页
为了精确表征含Na_2O渣系的脱硫能力,改善脱硫效果,基于熔渣离子与分子共存理论(IMCT)建立了CaO-SiO_2-MgO-Al_2O_3-Na_2O渣系结构单元的作用浓度计算模型和1 753 K时该渣系的脱硫热力学模型。并对渣系的总硫分配比及各自硫分配比的影... 为了精确表征含Na_2O渣系的脱硫能力,改善脱硫效果,基于熔渣离子与分子共存理论(IMCT)建立了CaO-SiO_2-MgO-Al_2O_3-Na_2O渣系结构单元的作用浓度计算模型和1 753 K时该渣系的脱硫热力学模型。并对渣系的总硫分配比及各自硫分配比的影响因素进行了讨论分析。理论结果表明,除LS,MgS外,随着Al_2O_3质量分数的增加,该渣系的脱硫能力明显下降,而MgO和Na_2O质量分数的增加,对提高渣系的脱硫能力具有明显的促进作用。此外,少量的Na_2O即可表现出很强的脱硫效果,这为含有Na_2O的冶金二次资源在铁水脱硫过程中的应用以及铁水脱硫渣系的优化提供了必要的理论依据。 展开更多
关键词 共存理论 质量作用浓度 硫分配比 热力学模型
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基于离子和分子共存理论的炉渣氧化能力表征 被引量:6
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作者 李鹏程 李晋岩 +3 位作者 张盟 张建良 张鉴 杨学民 《北京科技大学学报》 EI CAS CSCD 北大核心 2013年第12期1569-1579,共11页
选用文献报道的14个渣系铁氧化物活度aFetO作为基础实验数据,验证了基于炉渣离子–分子共存理论(IMCT)所定义的铁氧化物综合质量作用浓度NFetO表征炉渣氧化性的可能性和精度.为了得到14个渣系的NFetO,建立了CaO-SiO2-MgO-FeO-Fe2O3-MnO-... 选用文献报道的14个渣系铁氧化物活度aFetO作为基础实验数据,验证了基于炉渣离子–分子共存理论(IMCT)所定义的铁氧化物综合质量作用浓度NFetO表征炉渣氧化性的可能性和精度.为了得到14个渣系的NFetO,建立了CaO-SiO2-MgO-FeO-Fe2O3-MnO-Al2O3-P2O5渣系的IMCT-Ni模型,其他13个渣系NFetO可由该渣系的IMCT-Ni模型经简化得到.结果表明,铁氧化物综合质量作用浓度NFetO不仅可像活度aFetO一样表征炉渣氧化性,而且比实测aFetO精度更高. 展开更多
关键词 铁氧化物 质量作用浓度 活度系数 共存理论 结构单元
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MgO-B_2O_3二元系熔渣质量作用浓度计算模型 被引量:6
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作者 王广 王静松 +1 位作者 薛庆国 丁银贵 《中国有色金属学报》 EI CAS CSCD 北大核心 2011年第12期3143-3148,共6页
依据化学中广泛应用的同系线性规律,拟合钙、镁复合化合物标准反应吉布斯自由能之间的线性关系式,然后由3CaO.B2O3和2CaO.B2O3的标准反应吉布斯自由能求得3MgO.B2O3和2MgO.B2O3的标准反应吉布斯自由能,进而基于炉渣结构的共存理论和相图... 依据化学中广泛应用的同系线性规律,拟合钙、镁复合化合物标准反应吉布斯自由能之间的线性关系式,然后由3CaO.B2O3和2CaO.B2O3的标准反应吉布斯自由能求得3MgO.B2O3和2MgO.B2O3的标准反应吉布斯自由能,进而基于炉渣结构的共存理论和相图,推导MgO-B2O3二元渣系的热力学计算模型。结果表明:1 460℃时,在浓度为0.45<x(MgO)<0.80的范围内,理论计算的MgO-B2O3渣系的作用浓度N(B2O3)的变化规律与实测活度α(B2O3)是相同的,且拟合较好。 展开更多
关键词 炉渣 共存理论 质量作用浓度 活度 同系线性规律
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Applicability of law of mass action to distribution of manganese between slag melts and liquid iron 被引量:1
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作者 张鉴 《中国有色金属学会会刊:英文版》 CSCD 2001年第5期778-783,共6页
According to the law of mass action and the coexistence theory of slag structure, the distribution of manganese between MnO FeO SiO 2 and MgO MnO FeO SiO 2 slag melts as well as liquid iron was analyzed. It is shown t... According to the law of mass action and the coexistence theory of slag structure, the distribution of manganese between MnO FeO SiO 2 and MgO MnO FeO SiO 2 slag melts as well as liquid iron was analyzed. It is shown that K ′ Mn and K MnO are only dependent on temperature and don’t change with basicities and compositions of slag melts. So the distribution of manganese between the above mentioned slag melts and molten iron obeys the law of mass action. But analysis of experimental results from other sources shows that K ′ Mn and K MnO really change with basicities of slag, which is probably arisen from not approaching equilibrium under low basicity slag melts. 展开更多
关键词 manganese distribution the law of mass action the coexistence theory of slag structure mass action concentration
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Thermodynamic properties and mixing thermodynamic parameters of two-phase metallic melts 被引量:3
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作者 JianZhang 《Journal of University of Science and Technology Beijing》 CSCD 2005年第3期213-220,共8页
Based on the calculating model of metallic melts involving eutectic, the calculating equations of mixing thermodynamic parameters for two phase metallic melts have been formulated in the light of those equations of ho... Based on the calculating model of metallic melts involving eutectic, the calculating equations of mixing thermodynamic parameters for two phase metallic melts have been formulated in the light of those equations of homogeneous solutions. Irrespective as to whether the activity deviation relative to Raoultian behavior is positive or negative, or the deviation is symmetrical or unsym-metrical, the evaluated results not only agree well with experimental values, but also strictly obey the mass action law. This testifies that these equations can authentically reflect the structural reality and mixing thermodynamic characteristics of two-phase metallic melts. The calculating equations of mixing thermodynamic parameters for the model of two phase metallic melts offer two practical criteria (activity and mixing thermodynamic parameters) and one theoretical criterion (the mass action law). 展开更多
关键词 mass action law mixing thermodynamic parameters EUTECTIC activity mass action concentration
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Fe-C-O三元金属熔体作用浓度计算模型 被引量:5
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作者 朱荣 张鉴 仇永全 《北京科技大学学报》 EI CAS CSCD 北大核心 1996年第5期414-418,共5页
根据含化合物的金属熔体结构的共存理论,推导了Fe-C-O金属熔体作用浓度计算模型。计算的No′与相应的实测αo相符合,从而证明所得模型可以反映Fe-C-O金属熔体的结构本质。
关键词 金属熔体 活度 作用浓度 炼钢 计算模型
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熔渣中饱和相组元作用浓度的计算 被引量:5
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作者 成国光 张鉴 《北京科技大学学报》 EI CAS CSCD 北大核心 1994年第1期10-13,共4页
在炉渣结构共存理论的基础上,讨论了当溶渣中出现某组元饱和时的作用浓度计算.研究发现,实测的活度值与计算的作用浓度值之间存在明显的分配关系.考虑此分配比后,可使得计算的作用浓度值和实测的活度值相一致.文中分别讨论了Ca... 在炉渣结构共存理论的基础上,讨论了当溶渣中出现某组元饱和时的作用浓度计算.研究发现,实测的活度值与计算的作用浓度值之间存在明显的分配关系.考虑此分配比后,可使得计算的作用浓度值和实测的活度值相一致.文中分别讨论了CaO-siO2、MnO-SiO2和MgO-SiO2渣系的分配比,进而推导了lgL-1/T和析出自由能△G°-T的关系式. 展开更多
关键词 炉渣 作用浓度 炼钢 饱和相组元
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几种二元熔盐作用浓度计算模型初探 被引量:5
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作者 张鉴 《金属学报》 SCIE EI CAS CSCD 北大核心 1997年第5期515-523,共9页
按照正负离子未分开的条件分别对含固溶体、共晶体和复杂化合物的二元熔盐制定了作用浓度计算模型,计算结果与实测活度符合;按照正负离子分开的条件制定的计算模型,则未取得符合实际的结果,证明熔盐中正负离子的确是未分开的,原因... 按照正负离子未分开的条件分别对含固溶体、共晶体和复杂化合物的二元熔盐制定了作用浓度计算模型,计算结果与实测活度符合;按照正负离子分开的条件制定的计算模型,则未取得符合实际的结果,证明熔盐中正负离子的确是未分开的,原因是多数熔盐中缺乏介电物质. 展开更多
关键词 活度 熔盐 正负离子 作用浓度 二元熔盐
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CaO-SiO2-Al2O3-Na2O-TiO2-(MgO)渣系与碳饱和铁液间硫分配比的热力学模型 被引量:5
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作者 张康晖 张延玲 +1 位作者 李凤善 吴拓 《钢铁研究学报》 CAS CSCD 北大核心 2018年第4期265-272,共8页
炉渣离子与分子共存理论(IMCT)认为,渣中结构单元或离子对的作用浓度能像传统意义上的熔渣活度一样表征化学反应能力。通过建立CaO-SiO2-Al2O3-Na2O-TiO2-(MgO)渣系结构单元或离子对的作用浓度控制方程,并运用Matlab求解作用浓度,... 炉渣离子与分子共存理论(IMCT)认为,渣中结构单元或离子对的作用浓度能像传统意义上的熔渣活度一样表征化学反应能力。通过建立CaO-SiO2-Al2O3-Na2O-TiO2-(MgO)渣系结构单元或离子对的作用浓度控制方程,并运用Matlab求解作用浓度,从而建立1 450℃下该渣系与碳饱和铁液间硫分配比的热力学模型。模型计算的硫分配比与文献实测的硫分配比吻合较好,有助于预测熔渣与碳饱和铁液间的硫分配比。通过模型能计算出渣中CaO、Na2O和MgO各自的硫分配比及总的硫分配比,分析总的硫分配比受其他因素影响的变化趋势;计算出渣中CaO和Na2O各自对总硫分配比的贡献率,描述CaO和Na2O各自硫分配比贡献率受其他因素影响的变化趋势。 展开更多
关键词 硫分配比 共存理论 作用浓度 铁水预脱硫 热力学模型
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