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中国科学院力学研究所机构知识库
Knowledge Management System of Institue of Mechanics, CAS
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Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoOxS4-x2- Species in the Aqueous Phase by the ONIOM Method
期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 14
Authors:
He YY(何雨旸)
;
Gao,Caihong
;
Wei,Wei
;
Liu,Yun
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Submit date:2023/02/03
paleoredox proxy
ab initio molecular dynamics
implicit solvent model
dispersion correction
water-droplet
periodical boundary condition
干酪根热解和力学性质的多尺度研究
学位论文
硕士论文,北京: 中国科学院大学, 2022
Authors:
魏子雄
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Submit date:2023/01/03
干酪根
热解
反应力场分子动力学
介观尺度
细观力学
基于机器学习的干酪根热演化与流动的量子力学机制研究
学位论文
硕士论文,北京: 中国科学院大学, 2022
Authors:
马骏
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Submit date:2023/01/09
干酪根热演化,不可压缩薛定谔流动,机器学习,量子力学,轨道杂化
基于机器学习的干酪根分子重构及裂解化学-力学机制研究
学位论文
博士论文,北京: 中国科学院大学, 2022
Authors:
康 东亮
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Submit date:2023/01/13
力能学
组合爆炸
机器学习
干酪根分子重构
裂解化学-力学性质
煤和生物质中碱金属赋存及释放特性的光学诊断与模拟研究
学位论文
博士论文,北京: 中国科学院大学, 2022
Authors:
孙岑
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Submit date:2023/02/14
碱金属
可调谐半导体激光检测
赋存形态
异相释放
分子模拟
Probing multiscale dissolution dynamics in natural rocks through microfluidics and compositional analysis
期刊论文
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2022, 卷号: 119, 期号: 32, 页码: 9
Authors:
Ling BW(凌博闻)
;
Sodwatana, Mo
;
Kohli, Arjun
;
Ross, Cynthia M.
;
Jew, Adam
;
Kovscek, Anthony R.
;
Battiato, Ilenia
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Submit date:2023/03/20
dissolution
microfluidics
geochemistry
mineralogy
高碱煤热利用过程中碱金属释放特性研究进展
期刊论文
华中科技大学学报(自然科学版), 2022, 页码: 13
Authors:
李腾
;
赵京
;
魏小林
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Submit date:2022/10/17
高碱煤
碱金属
释放特性
NO_(x)
基元反应
竞争关系
Numerical Study of Mineral Nucleation and Growth on a Substrate
期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 11
Authors:
Yang FC(杨丰畅)
;
Yuan, Ke
;
Stack, Andrew G.
;
Starchenko, Vitalii
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Submit date:2022/08/10
crystal nucleation
crystal growth
mineral precipitation
pore-scale modeling
reactive transport modeling
Organic Matter Enrichment of Black Shale at the Turn of Ordovician-Silurian in the Paleosedimentary Center in Southern Sichuan Basin, Upper Yangtze Area
期刊论文
Lithosphere, 2022, 卷号: 2022, 期号: Special 12, 页码: 1-34
Authors:
Cui Y
;
Li XZ
;
Han LL
;
Guo W
;
Lin W
;
Chang R
;
Shen WJ(沈伟军)
;
Huang YZ
;
Qian C
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Submit date:2022/12/21
A review of machine learning in geochemistry and cosmochemistry: Method improvements and applications
期刊论文
APPLIED GEOCHEMISTRY, 2022, 卷号: 140, 页码: 13
Authors:
He YY(何雨旸)
;
Zhou, You
;
Wen, Tao
;
Zhang, Shuang
;
Huang, Fang
;
Zou, Xinyu
;
Ma, Xiaogang
;
Zhu, Yueqin
Adobe PDF(1705Kb)
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Submit date:2022/07/18
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Mapping
Water
soil prediction
Molecular machine learning
Reactive-transport modeling