作者： Miyi Li;Yu Hu;Liqiang Lv;Tao Fang;Long Hao;Shenhui Li;Yufeng Wu;Xiao Dong;Helei Liu （¹School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing 10081, China;²College of Chemical Engineering, Shijiazhuang University, Hebei 050035, China;³Beijing Institute of Aerospace Testing Technology, Beijing 100074, China;⁴Key Laboratory of Low-Carbon Conversion Science & Engineering, Shanghai Advanced Research Institute, Chinese Academy of Sciences (Shanghai Advanced Research Institute, Chinese Academy of Sciences)）

出处： Chemical Engineering Science 2023 Vol.275 P118751

关键词： Azeotrope;Salt distillation;Vapor-liquid equilibrium;Solvation;Coupling work

摘要： An azeotrope is a special vapor-liquid equilibrium in which the composition of two coexisting phases is equal. Due to its strong deviation from the Ra ...

作者： Li, Miyi¹;Lv, Liqiang²;Fang, Tao³;Hao, Long³;Li, Shenhui¹;Dong, Shoulong¹;Wu, Yufeng¹;Dong, Xiao¹;Liu, Helei^1,4 （¹Beijing Inst Technol, Sch Chem & Chem Engn, Beijing, Peoples R China.;²Shijiazhuang Univ, Coll Chem Engn, Shijiazhuang 050035, Hebei, Peoples R China.;³Beijing Inst Aerosp Testing Technol, Beijing 100074, Peoples R China.;⁴Chinese Acad Sci, Shanghai Adv Res Inst, Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China.）

出处： JOURNAL OF CHEMICAL THEORY AND COMPUTATION 2023 Vol.19 No.16 P5586-5601

关键词： VAPOR-LIQUID-EQUILIBRIA; SET MODEL CHEMISTRY; GIBBS FREE-ENERGY; ACTIVITY-COEFFICIENT; MOLECULAR SIMULATIONS; MONOVALENT IONS; MIXED-SOLVENTS; THERMODYNAMICS; SINGLE; WATER

摘要： Toassess the salt solubilities of six alkali halides in aqueoussystems, we proposed a thermodynamic cycle and an efficient molecularmodeling methodolo ...

作者： Li, Yao¹; Wang, Xingyu¹; Li, Linjun¹; Wang, Jiaxin¹; Dong, Xiao¹; Meng, Zihui¹; Xue, Min¹ （¹School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing; 100081, China）

出处： SSRN 2023

作者： Fan, Jing¹; Cai, Xiaolu¹; Chen, Hao¹; Wu, Lei¹; Dong, Xiao¹; Zhang, Wenxin¹; Qiao, Yu²; Meng, Zihui¹; Qiu, Lili¹; （¹School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing; 102488, China;²School of Mechanical and Materials Engineering, North China University of Technology, Beijing; 100144, China）

出处： Chemical Engineering Journal 2022 Vol.446 Part 5

关键词： Amorphous photonic crystal;Large-scale preparation;Robotic arms;Color analysis;Explosives detection

摘要： Leveraging advances in nanoscience and intelligent technology to engineer large-scale and stimuli-response amorphous photonic crystals (APCs) for use ...

作者： Qi Li¹;Songtao Liu¹;Nyv Mondele Mbola¹;Kenneth J Shea²;Zihui Meng¹;Xiao Dong¹;Min Xue³; （¹ School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing, 102488, China. ² Department of Chemistry, Irvine (UCI), University of California, Irvine, CA, 92697-2025, USA. ³ School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing, 102488, China. minxue@bit.edu.cn.）

出处： Analytical and bioanalytical chemistry 2022 Vol.414 No.26 P7695-7704

关键词： Hydrogel;Lactic acid detection;Oxamate derivative;Photonic crystal;Theoretical calculation.

摘要： The determination of lactic acid content has a guiding significance for disease diagnosis or food supervision. Herein, a hydrogel-based three-dimensio ...

作者： Yangyang Liu^1,2;Xu Xu^1,2;Jianwei Xin^1,3,2;Murtaza Ghulamb¹;Jing Fan¹;Xiao Dong¹;CA1;Lili Qiu¹;CA2;Min Xue¹;Zihui Meng¹;CA3 （¹School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing, 10081, PR China;²Yangyang Liu, Xu Xu, and Jianwei Xin equally to this work.;³College of Medicine, Yan\'an Uninersity, Yan\'an 716000, China）

出处： Chinese Journal of Analytical Chemistry 2022 P100215

关键词： Molecular imprinting;Photonic crystal;Explosives;High-throughput screening (HTS)

摘要： The on-site and high-throughput screening of explosives has become increasingly significant in counter-terrorism and national security. We propose a s ...

作者： Zhang, Wenxin¹;Qiu, Lili¹;Shea, Kenneth J.²;Fan, Jing¹;Liu, Yangyang¹;Zheng, Wenxiang¹;Xue, Min¹;Liu, Wenfang¹;Xu, Zhibin¹;E, Xiu-tian-feng¹;Dong, Xiao¹;Qiao, Yu¹;Meng, Zihui¹; （¹ Beijing Inst Technol, Sch Chem & Chem Engn, Beijing 10081, Peoples R China. ;² Univ Calif Irvine, Dept Chem, Irvine, CA 92697 USA.）

出处： ACS APPLIED MATERIALS & INTERFACES 2022 Vol.14 No.30 P35010-35019

关键词： STRATEGY; PH

摘要： The photonic crystals (PhCs) have a bright structural color, but their angular dependence and naked-eye observation subjectivity only apply for qualit ...

作者： 黄辞盼 （导师：董晓）

学位名称： 硕士

出处： 北京理工大学化工与环境学院 2016

关键词： 疼痛；糖配体；吗啡-6-β-D-葡萄糖醛酸苷；缩合；合成工艺

摘要： 目前，吗啡仍然是术后疼痛和癌痛等剧烈疼痛的临床一线镇痛药物，但是其恶心呕吐、便秘、呼吸抑制等副作用给患者带来诸多困扰。吗啡-6-β-D-葡萄糖醛酸苷(M6G)作为吗啡的代谢产物，镇痛活性强且毒副作用小，被医药领域工作者一致认定是未来吗啡的理想替代药物。目前，该药物在国外已经进入临床试验阶段，为此，开 ...

作者： 朴春梅 （导师：董晓）

学位名称： 硕士

出处： 北京理工大学化工与环境学院 2016

关键词： 光子晶体；甲基纤维素；羧甲基纤维素；可视化检测；气体响应

摘要： 本文将三维及二维聚甲基丙稀酸甲酯（PMMA）光子晶体分别包埋于甲基纤维素（MC）或羧甲基纤维素（CMC）聚合物薄膜中,从而制备出了具有蛋白石或反蛋白石结构的三维或二维纤维素光子晶体膜。此种方法操作简便,成本低,成膜速度快。通过扫描电子显微镜、光纤光谱仪、德拜环检测器对其内部结构和光学性质进行表征,结 ...

作者： 周星 （导师：董晓）

学位名称： 博士

出处： 北京理工大学化工与环境学院 2015

关键词： 量子计算；密度泛函理论；BTz；过渡态；硝化机理

摘要： 唑环类化合物分子中的氮含量较高，有大量的 N-N 和 C-N 等化学键，因此其生成焓较高，是优越的含能材。同时，杂环结构具有稳定性，故可以在杂环化合物上进行基础的修饰和改性，比如对杂环化合物上的硝基进行改性或者进行硝化、重氮化来增加化合物的含氮。唑系含能材料的优良性能使得其成为国内外火炸药领域比较活 ...