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寂寞倾城

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In addition to these phases which have been observed in nature, we performed calculations for many defective rocksalt structures: namely, different concentrations of Ta and N vacancies, N interstitials, and N antisites. In general, we
found that material with lower Ta concentrations had a relatively lower DOS at the Fermi level, which implies an increased resistivity. The results were reported in Ref. 10. In the present work, we consider (below) only the lowest energy of these defects, which are the N and Ta vacancies
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寂寞倾城(金币+3, 翻译EPI+1): 2011-03-04 23:02:06
除了在自然界中观察到的这些晶相外,我们还计算了一些有缺陷的石岩结构;比如,不同浓度的Ta、N空穴,N裂隙和N反位(缺陷)。总体上我们发现,在费米能级处,低Ta浓度的材料有着相对低的DOS,这意味着其具有增强的电阻率,该结果在文献10上已有报道。在本研究中,我们认为仅N和Ta空穴缺陷有着最低能量。
3楼2011-03-04 22:16:06
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寂寞倾城(金币+2): 2011-03-04 23:02:14
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Originally posted by 寂寞倾城 at 2011-03-04 20:38:51:
In addition to these phases which have been observed in nature, we performed calculations for many defective rocksalt structures: namely, different concentrations of Ta and N vacancies, N interstit ...

除了在自然界中能观察到的这些相态外,我们还计算了一些有缺陷的石岩结构;比如,不同浓度的Ta空穴,N空穴和反位。总体上我们发现,在费米能级处,低Ta浓度的材料有着相对低的DOS,这也意味有其有着增强的抵抗力,该结论在参考文献10上有报道。在当前的工作中,我们发现N和Ta空穴有着最低能量。
2楼2011-03-04 21:39:33
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