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矿床地球化学国家重... [18]
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Indexed By:SCI
Source Publication:Geochimica et Cosmochimica Acta
Language:英语
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Path-integral molecular dynamics predictions of equilibrium H and O isotope fractionations between brucite and water
期刊论文
Geochimica et Cosmochimica Acta, 2023, 卷号: 346, 页码: 207-222
Authors:
Caihong Gao
;
Yining Zhang
;
Qi Liu
;
Yuhong Yang
;
Yun Liu
Adobe PDF(2661Kb)
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Submit date:2024/06/11
Predicting nitrogen and oxygen kinetic isotope effects of nitrate reduction by periplasmic dissimilatory nitrate reductase
期刊论文
Geochimica et Cosmochimica Acta, 2021, 卷号: 293, 页码: 224-239
Authors:
Yuyang He
;
Yining Zhang
;
Siting Zhang
;
Yun Liu
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Submit date:2022/03/09
Planetary Environmental and Astrobiological Research Laboratory, School of Atmospheric Sciences, Sun Yat-sen University, Zhuhai, China, 2Center for Excellence in Comparative Planetology, Chinese Acade
期刊论文
Geochimica et Cosmochimica Acta, 2021, 卷号: 295, 页码: 80-97
Authors:
Long Li
;
Yuyang He
;
Zhe Zhang
;
Yun Liu
Adobe PDF(870Kb)
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Submit date:2022/03/02
First-principles calculations of equilibrium bromine isotope fractionations
期刊论文
Geochimica et Cosmochimica Acta, 2021, 卷号: 297, 页码: 65-81
Authors:
Caihong Gao
;
Yun Liu
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Submit date:2022/02/28
Nitrogen isotope fractionations among gaseous and aqueous NH4+, NH3, N2, and metal-ammine complexes: Theoretical calculations and applications
期刊论文
Geochimica et Cosmochimica Acta, 2021, 卷号: 295, 页码: 80-97
Authors:
Long Li
;
Yuyang He
;
Zhe Zhang
;
Yun Liu
Adobe PDF(870Kb)
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Submit date:2023/12/06
How to produce isotope anomalies in mantle by using extremely small isotope fractionations: A process-driven amplification effect?
期刊论文
Geochimica et Cosmochimica Acta, 2020, 卷号: 291, 页码: 19-49
Authors:
Yining Zhang;Yun Liu
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Submit date:2021/03/01
Isotope Anomalies
Amplification Effect
Multi-stage Melting And Crystallization
Monte Carlo Simulation
Ab-initio Calculations
Nfse
Mass-independent Isotope Fractionations
Predicting equilibrium intramolecular isotope distribution within a large organic molecule by the cutoff calculation
期刊论文
Geochimica et Cosmochimica Acta, 2020, 卷号: 269, 页码: 292-302
Authors:
Yuyang He
;
Huiming Bao
;
Yun Liu
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Submit date:2021/10/29
Equilibrium Mg isotope fractionation among aqueous Mg2+, carbonates, brucite and lizardite: Insights from first-principles molecular dynamics simulations
期刊论文
Geochimica et Cosmochimica Acta, 2019, 卷号: 250, 页码: 117-129
Authors:
Wenzhong Wang
;
Chen Zhou
;
Yun Liu
;
Zhongqing Wu
;
Fang Huang
Adobe PDF(2233Kb)
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Submit date:2020/12/04
Mg Isotopes
Equilibrium Fractionation
Density Functional Theory
First-principles Molecular Dynamics Simulations
Aqueous Mg2++
Concentration Effect
Carbonates
Brucite
Equilibrium Mg isotope fractionation among aqueous Mg2+, carbonates, brucite and lizardite: Insights from first-principles molecular dynamics simulations
期刊论文
Geochimica et Cosmochimica Acta, 2019, 卷号: 250, 页码: 117-129
Authors:
Wenzhong Wang
;
Chen Zhou
;
Yun Liu
;
Zhongqing Wu
;
Fang Huang
Adobe PDF(2233Kb)
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View/Download:169/0
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Submit date:2020/09/21
Mg Isotopes
Equilibrium Fractionation
Density Functional Theory
First-principles Molecular Dynamics Simulations
Aqueous mg2+concentration Effect
Carbonates
Brucite
Theoretical calibration of the triple oxygen isotope thermometer
期刊论文
Geochimica et Cosmochimica Acta, 2019, 卷号: 235, 页码: 237-245
Authors:
Justin Hayles
;
Caihong Gao
;
Xiaobin Cao
;
Yun Liu
;
Huiming Bao
Adobe PDF(795Kb)
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Submit date:2020/10/27
Mineral-water Equilibrium
Oxygen Isotope Equilibrium
Geothermometer
Triple-oxygen
D17o