机构

• 过程工程研究所 [14]
• 生态环境研究中心 [2]
• 力学研究所 [1]
• 地理科学与资源研究所 [1]
• 昆明植物研究所 [1]
• 广州能源研究所 [1]
• 更多

采集方式

• OAI收割 [20]

内容类型

• 期刊论文 [13]
• 学位论文 [5]
• SCI/SSCI论文 [1]
• 会议论文 [1]

发表日期

• 2023 [1]
• 2022 [2]
• 2021 [4]
• 2020 [2]
• 2019 [2]
• 2018 [1]
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学科主题

• Coal [1]
• Condensati... [1]
• Molecular ... [1]

筛选

浏览/检索结果: 共20条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序发表日期升序发表日期降序题名升序题名降序作者升序作者降序 Atomic-level analysis of migration and transformation of organic sodium in high-alkali coal pyrolysis using reactive molecular dynamics simulations 期刊论文  OAI收割 JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2023, 卷号: 11, 期号: 3, 页码: 110189 作者:  Sun C(孙岑);  Zhu, Aixue;  Xu, Tong;  Wei XL(魏小林);  Hong, Dikun   |  收藏  |  浏览/下载：14/0  |  提交时间：2023/09/05 Inherent organic sodium  ReaxFF  Pyrolysis  Molecular simulation  Py-GC/MS   Chemical structure effects on coal pyrolyzates and reactions by using large-scale reactive molecular dynamics 期刊论文  OAI收割 Fuel, 2022, 卷号: 327 作者:  Zheng, Mo;  Li, Xiaoxia;  Bai, Jin;  Guo, Li   |  收藏  |  浏览/下载：0/0  |  提交时间：2023/06/26 Cracking (chemical) - Indicators (chemical) - Mapping - Molecular dynamics - Reaction kinetics - Structure (composition) - Temperature - Thermogravimetric analysis   Revealing reaction compromise in competition for volatile radicals during coal pryolysis via ReaxFF MD simulation 期刊论文  OAI收割 Huagong Xuebao/CIESC Journal, 2022, 卷号: 73, 期号: 6, 页码: 2732-2741 作者:  Zheng, Mo;  Li, Xiaoxia   |  收藏  |  浏览/下载：0/0  |  提交时间：2023/06/26 Bituminous coal - Condensation - Pyrolysis - Stabilization - Tar - Temperature   Dynamic migration mechanism of organic oxygen in Fugu coal pyrolysis by large-scale ReaxFF molecular dynamics 期刊论文  OAI收割 JOURNAL OF ANALYTICAL AND APPLIED PYROLYSIS, 2021, 卷号: 156, 页码: 9 作者:  Gao, Mingjie;  Li, Xiaoxia;  Guo, Xin;  Chen, Lei;  Sun, Laizhi   |  收藏  |  浏览/下载：40/0  |  提交时间：2021/08/31 ReaxFF molecular dynamics simulation  Coal pyrolysis  Organic oxygen  Evolution trend  Migration mechanism   Assessment of personal exposure to environmentally persistent free radicals in airborne particulate matter 期刊论文  OAI收割 JOURNAL OF HAZARDOUS MATERIALS, 2021, 卷号: 409, 页码: - 作者:  Xu, Yang;  Qin, Linjun;  Liu, Guorui;  Zheng, Minghui;  Li, Da   |  收藏  |  浏览/下载：6/0  |  提交时间：2021/12/22 Environmentally persistent free radicals  Personal exposure  Air pollution  Particulate matter  Human risk   Dynamic trends for char/soot formation during secondary reactions of coal pyrolysis by large-scale reactive molecular dynamics 期刊论文  OAI收割 JOURNAL OF ANALYTICAL AND APPLIED PYROLYSIS, 2021, 卷号: 155, 页码: 11 作者:  Zheng, Mo;  Li, Xiaoxia   |  收藏  |  浏览/下载：25/0  |  提交时间：2021/08/31 Char  soot precursors  Secondary reactions  Large-scale ReaxFF MD simulation  Tar radicals  Competitive reactions   Insight into Tar Formation Mechanism during Catalytic Pyrolysis of Biomass over Waste Aluminum Dross 期刊论文  OAI收割 APPLIED SCIENCES-BASEL, 2021, 卷号: 11, 期号: 1, 页码: 15 作者:  Liu, Peng;  Liu, Li;  Zhou, Zhengzhong;  Yuan, Haoran;  Zheng, Tao   |  收藏  |  浏览/下载：19/0  |  提交时间：2021/10/27 catalytic pyrolysis  tar formation  carbon structure  waste aluminum dross  free radical   Risk evaluation of environmentally persistent free radicals in airborne particulate matter and influence of atmospheric factors 期刊论文  OAI收割 ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY, 2020, 卷号: 196, 页码: 1-9 作者:  Xu, Yang;  Yang, Lili;  Wang, Xiaoping;  Zheng, Minghui;  Li, Cui   |  收藏  |  浏览/下载：10/0  |  提交时间：2021/09/14 Environmentally persistent free radicals  Airborne fine particulate matter  Daily inhalation risk  Air pollution  Haze days   Capturing the dynamic profiles of products in Hailaer brown coal pyrolysis with reactive molecular simulations and experiments 期刊论文  OAI收割 FUEL, 2020, 卷号: 268, 页码: 12 作者:  Zheng, Mo;  Pan, Yang;  Wang, Ze;  Li, Xiaoxia;  Guo, Li   |  收藏  |  浏览/下载：23/0  |  提交时间：2020/05/21 Coal pyrolysis  SVUV-PIMS  ReaxFF MD simulation  Py-GC/MS  Reaction pathways   低变质煤热解油气催化提质研究 学位论文  OAI收割 : 中国科学院大学, 2019 作者:  王德亮   |  收藏  |  浏览/下载：20/0  |  提交时间：2020/06/17 煤热解,催化提质,赤泥基催化剂,烷基化废酸,反应调控