硅酸盐学报

硝酸镁对钡掺杂低钙固碳胶凝材料碳酸化性能的影响

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边亚东 , 张濮久 , 武琦翔 , 易紫璇 , 蒋昌乐 , 朱建平

硅酸盐学报 | 第二十八届中国科协年会智能建造关键无机非金属材料–AI驱动水泥基材料创新专题-研究论文 2026,54(10): 3389-3397

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硅酸盐学报 |第二十八届中国科协年会智能建造关键无机非金属材料–AI驱动水泥基材料创新专题-研究论文 2026 , 54 (10) : 3389 -3397

硝酸镁对钡掺杂低钙固碳胶凝材料碳酸化性能的影响

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边亚东, 张濮久, 武琦翔, 易紫璇, 蒋昌乐, 朱建平

作者信息

河南理工大学材料科学与工程学院，河南　焦作　454003

通讯作者:

朱建平（1978-），男，博士，教授。

作者简介:

边亚东（1975-），男，博士，教授。

Effect of Barium lon Doping Combined with Magnesium Nitrate on the Carbonation Performance of Low Calcium Carbonatable Binder

Yadong BIAN, Pujiu ZHANG, Qixiang WU, Zixuan YI, Changle JIANG, Jianping ZHU

Affiliations

School of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo 454003, Henan, China

Corresponding Author:

ZHU Jianping (1978-), male, Ph.D., Professor. E-mail: jianpingzhu@hpu.edu.cn

BIAN Yadong (1975-), male, Ph.D., Professor. E-mail: byd@hpu.edu.cn

出版时间: 2026-07-30 doi: 10.14062/j.issn.0454-5648.20260278

文章导航

摘要

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中国水泥行业碳中和时限持续通近，亟须发展具有高效固碳能力的功能性水泥基材料。低钙固碳胶凝材料（LCCB）因具备低钙硅比与低煅烧温度的优势，在碳减排方面前景良好，然而其碳酸化性能较差，限制了其碳减排能力的应用。为克服这一缺陷，本工作通过第一性原理计算与实验结合的方法，系统考察了钡（Ba）离子掺杂与硝酸镁（Mg（NO₃）₂）溶液协同对LCCB碳酸化性能的影响。结果表明，Ba离子的掺杂能让硅灰石（CS）与硅钙石（C₃S₂）的置换多面体体积增大，为碳酸化初期钙离子的解离提供了热力学驱动力，当Mg（NO₃）₂溶液浓度为0.1 g/mL、Ba离子掺量为原料中钙离子摩尔量的1%时，碳酸化8 h的LCCB碳酸化初期反应速率与碳酸化活性有较大提升，此时抗压强度和固碳率分别为101.7 MPa和18.33%，相较于未碳酸化样品提升了53.63%和55.34%。碳酸化产物与微观结构分析表明，Ba离子掺杂与Mg（NO₃）₂协同作用促进了碳酸化产物CaCO₃及无定形硅胶的快速生成，降低孔隙率并优化了孔隙结构。这些发现表明协同改性策略是改善LCCB碳酸化性能的一种有效路径。

关键词

固碳胶凝材料 / 固碳率 / 碳酸化性能 / 孔隙结构

Abstract

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Introduction

With its carbon neutrality target fast approaching, China's cement industry urgently needs to develop functional cement-based materials with high carbon sequestration capacity. low-calcium carbonatable binders (LCCB) show great potential for carbon reduction because of their low calcium-to-silica ratio and low calcination temperature; but their poor carbonation performance limits their carbon-reduction applications. To address this limitation, we systematically investigated the effects of barium (Ba) ion doping and magnesium nitrate (Mg(NO₃)₂) solution on the carbonation performance of LCCB by combining first-principles calculations with experimental tests. The results indicate that Ba ion doping increases the volume of the substitution polyhedra in wollastonite (CS) and rankinite (C₃S₂), providing a thermodynamic driving force for the dissociation of calcium ions during the early stages of carbonation. When the concentration of Mg(NO₃)₂ solution is 0.1 g/mL and the Ba ion doping level is 1% (molar fraction) of the calcium ions in the raw material, the initial reaction rate and carbonation activity of LCCB after 8 h of carbonation show significant improvement. In this case, the compressive strength and carbon sequestration rate are 101.7 MPa and 18.33%, respectively, representing increases of 53.63% and 55.34%. Analyses of carbonation products and microstructure indicate that Ba ion doping acts synergistically with Mg(NO₃)₂ to promote the rapid formation of CaCO₃ and amorphous silica gel, reduce porosity, and optimize the pore structure. These findings show that a synergistic modification strategy can effectively improve the carbonation performance of LCCB.

Results and discussion

The mechanism by which Ba ions and Mg(NO₃)₂ synergistically enhanced the carbonation performance of LCCB was elucidated by combining first-principles calculations with experiments. The energy barrier for calcium ion dissolution decreased, and the synergy between Ba ions and Mg(NO₃)₂ also accelerated the early-stage carbonation rate of LCCB, creating favorable conditions for improving the carbon sequestration efficiency and compressive strength. Moreover, the marked increase in carbonation products effectively filled the larger pores, and the presence of aragonite further promoted the carbonation process. Thus, the synergy between Ba ions and Mg(NO₃)₂ effectively improved the carbonation performance of LCCB and provided an effective strategy for developing functional cement-based materials with high carbon dioxide sequestration capacity.

Conclusions

Ba ion doping and Mg(NO₃)₂ act synergistically to markedly improve the carbon sequestration rate and carbonation hardening performance of LCCB. During the early stage of carbonation, Mg(NO₃)₂ and Ba ions work together to increase the carbonation reaction rate and reactivity of LCCB, thereby speeding up the carbonation process. When the Mg(NO₃)₂ content reaches 1%, its synergistic effect with Ba ions is optimal. At this dosage, compressive strength, reactivity, carbon sequestration rate, and porosity all reach their optimal values, which shows the critical importance of the Mg(NO₃)₂ level. The findings of this study expand the theoretical framework for improving LCCB's carbonation performance, offer a scientific basis for advancing the use of carbon-sequestering cement-based materials, and foster green, circular, and synergistic progress in the building materials industry.

Key words

carbon-sequestering cementitious material / carbon sequestration rate / carbonation performance / pore structure

引用本文

边亚东, 张濮久, 武琦翔, 易紫璇, 蒋昌乐, 朱建平. 硝酸镁对钡掺杂低钙固碳胶凝材料碳酸化性能的影响. 硅酸盐学报, 2026 , 54 (10) : 3389 -3397 . DOI: 10.14062/j.issn.0454-5648.20260278

Yadong BIAN, Pujiu ZHANG, Qixiang WU, Zixuan YI, Changle JIANG, Jianping ZHU. Effect of Barium lon Doping Combined with Magnesium Nitrate on the Carbonation Performance of Low Calcium Carbonatable Binder[J]. Journal of the Chinese Ceramic Society, 2026 , 54 (10) : 3389 -3397 . DOI: 10.14062/j.issn.0454-5648.20260278

基金

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国家自然科学基金面上项目(52472025)

参考文献

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文献

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参考文献引证文献

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2026年第54卷第10期

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doi: 10.14062/j.issn.0454-5648.20260278

接收时间：2026-04-28
首发时间：2026-10-22
出版时间：2026-07-30

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收稿日期：2026-04-28
修回日期：2026-05-28

基金

国家自然科学基金面上项目(52472025)

作者信息

河南理工大学材料科学与工程学院，河南　焦作　454003

通讯作者:

朱建平（1978-），男，博士，教授。

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2种不同金属材料的力学参数

科 Family	属数 Number of genus	种数 Number of species	占总种数比例 Percentage of total species (%)	属 Genus	种数 Number of species	占总种数比例 Percentage of total species (%)
鹅膏菌科Amanitaceae	2	11	5.26	鹅膏菌属 Amanita	10	4.78
小菇科 Mycenaceae	2	12	5.74	丝盖伞属 Inocybe	5	2.39
多孔菌科 Polyporaceae	8	14	6.70	蜡蘑属 Laccaria	5	2.39
红菇科 Russulaceae	3	23	11.00	小皮伞属 Marasmius	6	2.87
				小菇属 Mycena	11	5.26
				光柄菇属 Pluteus	5	2.39
				红菇属 Russula	17	8.13
				栓菌属 Trametes	5	2.39

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