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The Gaussian Approximation Potential: An Interatomic Potential Derived from First Principles Quantum Mechanics - Springer Theses Albert Bartok-Partay
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The Gaussian Approximation Potential: An Interatomic Potential Derived from First Principles Quantum Mechanics - Springer Theses
Albert Bartok-Partay
The framework of Gaussian Approximation Potentials that is developed in this thesis allows us to generate interatomic potentials automatically, based on quantum mechanical data. The resulting potentials offer several orders of magnitude faster computations, while maintaining quantum mechanical accuracy.
101 pages, 29 black & white illustrations, 2 colour illustrations, biography
| メディア | 書籍 Hardcover Book (ハードカバー付きの本) |
| リリース済み | 2010年8月6日 |
| ISBN13 | 9783642140662 |
| 出版社 | Springer-Verlag Berlin and Heidelberg Gm |
| ページ数 | 90 |
| 寸法 | 155 × 235 × 13 mm · 272 g |
| 言語 | ドイツ語 |
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