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Boundary conditions and point defect computer simulation

 

作者: K.M. Miller,  

 

期刊: Radiation Effects  （Taylor Available online 1981）
卷期: Volume 57, issue 3  

页码: 93-98

 

ISSN:0033-7579

 

年代: 1981

 

DOI:10.1080/01422448008226507

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

Three physically distinct boundary conditions have been previously used in the real space computer simulation of point defects. The difference between them is discussed and their effect on vacancy formation energy is investigated.

 

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