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检索条件"作者=Matthew Horton"
156 条 记 录,以下是1-10 订阅
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A charge-density-based general cation insertion algorithm for generating new Li-ion cathode materials
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npj Computational Materials 2020年 第1期6卷 336-342页
作者: Jimmy-Xuan Shen matthew horton Kristin A.Persson Department of Materials Science and Engineering University of CaliforniaBerkeleyBerkeleyCA 94720USA Energy Technologies Area Lawrence Berkeley National LaboratoryBerkeley 94720USA
Future lithium(Li)energy storage technologies,in particular solid-state configurations with a Li metal anode,opens up the possibility of using cathode materials that do not necessarily contain Li in its as-made *** ac... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
High-throughput prediction of the ground-state collinear magnetic order of inorganic materials using Density Functional Theory
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npj Computational Materials 2019年 第1期5卷 588-598页
作者: matthew Kristofer horton Joseph Harold Montoya Miao Liu Kristin Aslaug Persson Energy Technologies Area Lawrence Berkeley National LaboratoryBerkeleyCAUSA Institute of Physics Chinese Academy of SciencesBeijingChina Department of Materials Science University of California BerkeleyBerkeleyCA 94720USA
We present a robust,automatic high-throughput workflow for the calculation of magnetic ground state of solid-state inorganic crystals,whether ferromagnetic,antiferromagnetic or ferrimagnetic,and their associated magne... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
Topological graph-based analysis of solid-state ion migration
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npj Computational Materials 2023年 第1期9卷 1337-1341页
作者: Jimmy-Xuan Shen Haoming Howard Li Ann Rutt matthew K.horton Kristin A.Persson Materials Science Division Lawrence Livermore National LaboratoryLivermoreCAUSA Materials Sciences Division Lawrence Berkeley National LaboratoryBerkeleyUSA Department of Material Science and Engineering University of CaliforniaBerkeleyCAUSA Molecular Foundry Lawrence Berkeley National LaboratoryBerkeleyUSA
To accelerate the development of ion conducting materials,we present a general graph-theoretic analysis framework for ion migration in any crystalline *** nodes of the graph represent metastable sites of the migrating... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
An improved symmetry-based approach to reciprocal space path selection in band structure calculations
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npj Computational Materials 2020年 第1期6卷 731-736页
作者: Jason M.Munro Katherine Latimer matthew K.horton Shyam Dwaraknath Kristin A.Persson Energy Technologies Area Lawrence Berkeley National LaboratoryBerkeleyCA 94720USA Department of Physics University of CaliforniaBerkeleyCA 94720USA Department of Materials Science University of CaliforniaBerkeleyCA 94720USA
Band structures for electrons,phonons,and other quasiparticles are often an important aspect of describing the physical properties of periodic *** commonly,energy bands are computed along a one-dimensional path of hig... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
A flexible and scalable scheme for mixing computed formation energies from different levels of theory
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npj Computational Materials 2022年 第1期8卷 1857-1867页
作者: Ryan S.Kingsbury Andrew S.Rosen Ayush S.Gupta Jason M.Munro Shyue Ping Ong Anubhav Jain Shyam Dwaraknath matthew K.horton Kristin A.Persson Department of Materials Science and Engineering University of California BerkeleyBerkeleyCA94720USA Energy Technologies Area Lawrence Berkeley National LaboratoryBerkeleyCA94720USA Materials Science Division Lawrence Berkeley National LaboratoryBerkeleyCA94720USA Miller Institute for Basic Research in Science University of CaliforniaBerkeleyCA94720USA University of California San Diego La JollaCA92093USA Molecular Foundry Lawrence Berkeley National LaboratoryBerkeleyCA94720USA
Computational materials discovery efforts are enabled by large databases of properties derived from high-throughput density functional theory(DFT),which now contain millions of calculations at the generalized gradient... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
High-throughput predictions of metal-organic framework electronic properties:theoretical challenges,graph neural networks,and data exploration
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npj Computational Materials 2022年 第1期8卷 1053-1062页
作者: Andrew S.Rosen Victor Fung Patrick Huck Cody T.O’Donnell matthew K.horton Donald G.Truhlar Kristin A.Persson Justin M.Notestein Randall Q.Snurr Department of Materials Science and Engineering University of CaliforniaBerkeleyCA94720USA Miller Institute for Basic Research in Science University of CaliforniaBerkeleyBerkeleyCA94720USA Materials Science Division Lawrence Berkeley National LaboratoryBerkeleyCA94720USA Department of Chemical and Biological Engineering Northwestern UniversityEvanstonIL60208USA Center for Nanophase Materials Sciences Oak Ridge National LaboratoryOak RidgeTN37831USA Energy Technologies Area Lawrence Berkeley National LaboratoryBerkeleyCA94720USA Department of Chemistry Chemical Theory Centerand Minnesota Supercomputing InstituteUniversity of MinnesotaMinneapolisMN55455USA Molecular Foundry Lawrence Berkeley National LaboratoryBerkeleyCA94720USA
With the goal of accelerating the design and discovery of metal–organic frameworks(MOFs)for electronic,optoelectronic,and energy storage applications,we present a dataset of predicted electronic structure properties ... 详细信息
来源: 维普期刊数据库 维普期刊数据库 评论
Humic acid transport in saturated porous media:Influence of flow velocity and influent concentration
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Journal of Environmental Sciences 2014年 第12期26卷 2554-2561页
作者: Xiaorong Wei Mingan Shao Lina Du Robert horton State Key Laboratory of Soil Erosion and Dryland Farming on the Loess Plateau Northwest A&F University Institute of Geographical Sciences and Natural Resources Research Chinese Academy of Sciences Department of Agronomy Iowa State University Ames IA 50011 USA
Understanding the transport of humic acids(HAs) in porous media can provide important and practical evidence needed for accurate prediction of organic/inorganic contaminant transport in different environmental media... 详细信息
来源: 维普期刊数据库 维普期刊数据库 同方期刊数据库 同方期刊数据库 评论
Response of nephelometric turbidity to hydrodynamic particle size of fine suspended sediment
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International Journal of Sediment Research 2020年 第5期35卷 444-454页
作者: Christina Bright Sarah Mager Sophie horton School of Geography University of Otago
Turbidity is used as a surrogate for suspended sediment concentration(SSC),and as a regulatory tool for indicating land use disturbance and environmental *** relates linearly to suspended material,however,can show non... 详细信息
来源: 同方期刊数据库 同方期刊数据库 评论
Single and Joint Multifractal Analysis of Soil Particle Size Distributions
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Pedosphere 2011年 第1期21卷 75-83页
作者: LI Yi LI Min R. horton Northwest Agriculture and Forestry Sci-Tech University Yangling 712100 (China) Department of Soil Science University of Saskatchewan Saskatoon SK STN 5A8 (Canada) Department of Agronomy Iowa State University Ames IA 50011 (USA)
It is noted that there has been little research to compare volume-based and number-based soil particle size distributions (PSDs). Our objectives were to characterize the scaling properties and the possible connectio... 详细信息
来源: 维普期刊数据库 维普期刊数据库 同方期刊数据库 同方期刊数据库 评论
Impact of Gully on Soil Moisture of Shrubland in Wind-Water Erosion Crisscross Region of the Loess Plateau
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Pedosphere 2008年 第5期18卷 674-680页
作者: HUO Zhu SHAO Ming-An R. horton Key Laboratory of Water Cycle and Related Land Surface Processes Institute of Geographical Sciences and Natural Resources Research Chinese Academy of Sciences Beijing 100101 (China). Graduate University of the Chinese Academy of Sciences Beijing 100049 (China) Agronomy Department of Iowa State University Ames IA 50011-1010 (USA)
The most serious erosion on the Loess Plateau of China exists in the wind-water erosion crisscross region where the annual precipitation is about 400 mm,the ecological environment is very fragile,and water is the key ... 详细信息
来源: 维普期刊数据库 维普期刊数据库 同方期刊数据库 同方期刊数据库 评论