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1. ARTICLE
Catalytic conversion mechanism of guaiacol as the intermediate of lignin catalytic pyrolysis on MgO surface: Density functional theory calculation
Author
by
Bai, Mengna
a, ⁎
;
Song, Zhiheng
a
;
Yang, Zheng
b
;
Guo, Zhiqing
a
;
Liu, Yizhou
b
;
Guo, Haoran
a
;
Lei, Hanwu
c
;
Huo, Erguang
b, c, ⁎
Source
In
Journal of Molecular Liquids
1 January 2023 369
Full Text (ScienceDirect)
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2. ARTICLE
Control of heat-integrated indirect triple-column extractive distillation for separating ternary azeotropic mixture tetrahydrofuran-ethyl acetate-water
Author
by
Zhu, Shuangshuang
a
;
Yang, Ao
b, c
;
Kong, Zong Yang
d, ⁎
;
Sun, Shirui
e, ⁎
;
Bai, Mengna
f
;
Sunarso, Jaka
g
Source
In
Separation and Purification Technology
1 March 2023 308
Full Text (ScienceDirect)
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3. ARTICLE
Gasification of α-O-4 linkage lignin dimer in supercritical water into hydrogen and carbon monoxide: Reactive molecular dynamic simulation study
Author
by
Song, Zhiheng
a, b
;
Bai, Mengna
a, b, ⁎
;
Yang, Zheng
a, c
;
Lei, Hanwu
d
;
Qian, Moriko
d
;
Zhao, Yunfeng
e
;
Zou, Rongge
d
;
Wang, Chenxi
d
;
Huo, Erguang
a, c, d, ⁎
Source
In
Fuel
1 December 2022 329
Full Text (ScienceDirect)
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4. ARTICLE
The thermal decomposition and interaction mechanism of HFC-245fa/HFC-227ea mixture: A reactive molecular dynamic simulation and density functional method calculation study
Author
by
Huo, Erguang
a, b, c, ⁎
;
Wang, Shukun
d
;
Bai, Mengna
a, e, ⁎
Source
In
Computational and Theoretical Chemistry
November 2022 1217
Full Text (ScienceDirect)
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5. ARTICLE
Pyrolysis mechanism study of n-heptane as an endothermic hydrocarbon fuel: A reactive molecular dynamic simulation and density functional theory calculation study
Author
by
Huo, Erguang
a, b, ⁎
;
Zhang, Shijie
c
;
Xin, Liyong
b
;
Wang, Shukun
d
;
Cai, Shouyin
b
;
Zhang, Lu
b
;
Bai, Mengna
e, ⁎
Source
In
Computational and Theoretical Chemistry
May 2022 1211
Full Text (ScienceDirect)
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6. ARTICLE
Thermal decomposition and interaction mechanism of HFC-227ea/n-hexane as a zeotropic working fluid for organic Rankine cycle
Author
by
Huo, Erguang
a
;
Hu, Zheng
b
;
Wang, Shukun
c
;
Xin, Liyong
d
;
Bai, Mengna
e, ∗
Source
In
Energy
1 May 2022 246
Full Text (ScienceDirect)
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7. ARTICLE
Sustainable design and multi-objective optimization of eco-efficient extractive distillation with single and double entrainer(s) for separating the ternary azeotropic mixture tetrahydrofuran/ethanol/methanol
Author
by
Yang, Ao
a
;
Wang, Wenhe
a
;
Sun, Shirui
b, ⁎
;
Shi, Tao
c
;
Ren, Jingzheng
c
;
Bai, Mengna
d
;
Shen, Weifeng
b, ⁎
Source
In
Separation and Purification Technology
15 March 2022 285
Full Text (ScienceDirect)
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8. ARTICLE
Density functional theory study on the decomposition mechanism of HFC-32 on a Cu(1 1 1) surface: The impact of H2O and O2
Author
by
Bai, Mengna
a, ⁎
;
Chen, Jiu
b
;
Feng, Zhitao
c
;
Sun, Yanyan
a
;
Hu, Yingyuan
a
;
Zhao, Xin
a
Source
In
Journal of Molecular Liquids
15 February 2022 348
Full Text (ScienceDirect)
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9. ARTICLE
Towards sustainable separation of the ternary azeotropic mixture based on the intensified reactive-extractive distillation configurations and multi-objective particle swarm optimization
Author
by
Yang, Ao
a, ∗∗∗
;
Su, Yang
b
;
Sun, Shirui
c
;
Shen, Weifeng
c, ∗
;
Bai, Mengna
d
;
Ren, Jingzheng
e, ∗∗
Source
In
Journal of Cleaner Production
15 January 2022 332
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10. ARTICLE
Thermal decomposition and interaction mechanism of HFC-134a/HFC-32 mixture in Organic Rankine Cycle
Author
by
Si, Mingjin
a, b, 1
;
Kuai, Le
a, 1
;
Huo, Erguang
a, b, c, ⁎
;
Li, Lize
a, b
;
Bai, Mengna
a, d, ⁎
Source
In
Journal of Environmental Chemical Engineering
January 2022
Full Text (ScienceDirect)
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