The SIESTA method; developments and applicability
نویسندگان
چکیده
منابع مشابه
The SIESTA method; developments and applicability.
Recent developments in and around the SIESTA method of first-principles simulation of condensed matter are described and reviewed, with emphasis on (i) the applicability of the method for large and varied systems, (ii) efficient basis sets for the standards of accuracy of density-functional methods, (iii) new implementations, and (iv) extensions beyond ground-state calculations.
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ژورنال
عنوان ژورنال: Journal of Physics: Condensed Matter
سال: 2008
ISSN: 0953-8984,1361-648X
DOI: 10.1088/0953-8984/20/6/064208