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[会议论文] 作者:Hua Guo,
来源:第十五届全国化学动力学会议 年份:2017
Within the familiar Born-Oppenheimer approximation,nuclear dynamics,including tunneling,is often envisioned to occur on an adiabatic potential energy surface.Ho...
A multifunctional nanoparticle system combines sonodynamic therapy and chemotherapy to treat hepatoc
[期刊论文] 作者:Guoyun Wan,Hua Guo,Yuanyuan Li,
来源:黑龙江科技学院学报 年份:2017
为探究吕家坨井田地质构造格局,根据钻孔勘探资料,采用分形理论和趋势面分析方法,研究了井田7...
Construction of Potential Energy Surface for ClH2O System and Its Application in Ring Polymer Molecu
[会议论文] 作者:Junxiang Zuo,Hua Guo,Daiqian Xie,
来源:第十五届全国化学动力学会议 年份:2017
A new and more accurate full-dimensional global permutation invariant polynomial-neural network(PIP-NN)potential energy surface(PES)for the ground electroni...
[会议论文] 作者:Yongle Li,Hua Guo,Daiqian Xie,
来源:第十五届全国化学动力学会议 年份:2017
The determination of chemical reaction coefficients plays central role in the chemical kinetics modeling of combustion,atmospheric and interstellar chemistry by...
Construction of Potential Energy Surface for ClH2O System and Its Application in Ring Polymer Molecu
[会议论文] 作者:Junxiang Zuo,Hua Guo,Daiqian Xie,
来源:第十五届全国化学动力学会议 年份:2017
A new and more accurate full-dimensional global permutation invariant polynomial-neural network(PIP-NN)potential energy surface(PES)for the ground electronic state of the ClH2O system is developed by...
[会议论文] 作者:Xixi Hu,Bin Jiang,Hua Guo,Daiqian Xie,
来源:中国化学会第14 届全国计算(机)化学学术会议暨分子模拟国际论坛 年份:2017
Dissociative chemisorption(DC) is the initial and often rate-limiting step in heterogeneous catalysis....
[会议论文] 作者:Xueyao Zhou,Francesco Nattino,Geert-Jan Kroes,Hua Guo,Bin Jiang,
来源:第十三届全国量子化学会议 年份:2017
The dissociation of methane on metal surface has become one of the most studied gas-surface reactions due to its industrial significance.In the present work,we developed a chemically accurate,fifteen-...
Scattering and Reaction Dynamics on Chemically Accurate 15D Potential Energy Surface for Methane Dis
[会议论文] 作者:Xueyao Zhou,Francesco Nattino,Geert-Jan Kroes,Hua Guo,Bin Jiang,
来源:第十五届全国化学动力学会议 年份:2017
The dissociation of methane on metal surface has become one of the most studied gas-surface reactions due to its industrial significance....
[会议论文] 作者:PANG Hui-mei,QIN Xiao-ling,LIU Tao-tao,WEI Wen-xing,CHENG Dao-hai,LU Hua,GUO Qing,JING Li,
来源:第一届全国临床用药风险监测与防控学术研讨会 年份:2017
Objective: Previous studies had demonstrated that urinary kidney injury molecule-1 (uKIM-1) and neutrophil gelatinase-associated lipocalin (uNGAL) were superior to serum creatinine (Scr) in detecting...
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