AB INITIO MODELING OF THERMOMECHANICAL PROPERTIES OF Mo- BASED ALLOYS FOR FOSSIL ENERGY CONVERSIONNETL Project DE-FE0004007

The 2011 University Coal Research/Historically Black Colleges and Universities and Other Minority Institutions Contractors Review Conference.

Others  :  http://www.netl.doe.gov/publications/proceedings/11/coal%20research/presentations/NETL-UCR-6-7-2011_Wai-Yim%20Ching.pdf
PID  :  32235

来源: CEUR

【 摘 要 】

OutlineI. Background of the projectII. Project outline andobjectivesIII. Technical approach and methods usedIV.Results on Mo-based alloys a. Electronic structure and bondingb. Mechanical and vibrational propertiesV. Conclusions