enamel 发表于 2025-3-21 17:05:41
书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile影响因子(影响力)<br> http://impactfactor.cn/if/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile影响因子(影响力)学科排名<br> http://impactfactor.cn/ifr/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile网络公开度<br> http://impactfactor.cn/at/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile网络公开度学科排名<br> http://impactfactor.cn/atr/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile被引频次<br> http://impactfactor.cn/tc/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile被引频次学科排名<br> http://impactfactor.cn/tcr/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile年度引用<br> http://impactfactor.cn/ii/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile年度引用学科排名<br> http://impactfactor.cn/iir/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile读者反馈<br> http://impactfactor.cn/5y/?ISSN=BK0232661<br><br> <br><br>书目名称Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile读者反馈学科排名<br> http://impactfactor.cn/5yr/?ISSN=BK0232661<br><br> <br><br>桶去微染 发表于 2025-3-21 21:42:17
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Quantum Mechanical Simulation of Electron Dynamics on Surfaces of Materials, including both theoretical and practical aspects. The practicality and accuracy of TDDFT-OS method are demonstrated with two numerical examples: the time-dependent electron transport through a series of quasi-one-dimensional atomic chains and the real-time electronic dynamics on a two-dimensional graphene surface.溺爱 发表于 2025-3-22 21:11:56
Accelerated Molecular Dynamics Methods for Long-Time Simulations in Materialsapproximates what would result from an extremely long molecular dynamics simulation, and the most accurate of the methods can do this to arbitrary accuracy. We present some examples of applications of these methods and discuss the greatest ongoing challenge for the methods.放肆的你 发表于 2025-3-23 05:15:08
Prediction of Heats of Formation of Polycyclic Saturated Hydrocarbons Using the XYG3 Double Hybrid FFs in good agreement with those from experiments or the G4 theory. The present success holds the promise for the future study on other larger potentially important hydrocarbons as candidates of high performance fuels.使服水土 发表于 2025-3-23 06:53:05
0933-033Xleading researchers on the impacts of Goddard’s work in che.This book provides a broad and nuanced overview of the achievements and legacy of Professor William (“Bill”) Goddard in the field of computational materials and molecular science. Leading researchers from around the globe discuss Goddard’s