Description: SIESTA was born in 1996 to implement, in self consistent DFT, the order-N techniques developed for tight-binding in the early 1990s. Because order-N was carefully imposed in all the code, this was very efficient, specially for large systems and moderate precisions. Later, the need for higher precisions, and the addition of many new functionalities, imposed compromises to the order-N philosophy, but efficiency kept being one of SIESTA s strongest points.
- [10_MD_1] - This material is material of Shanghai Ji
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