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The structure of grain boundaries in strontium titanate: theory, simulation, and electron microscopy |
Authors: von Alfthan, S.; Benedek, N. A.; Chen, L.; Chua, A.; Cockayne, D.; Dudeck, K.; Elsässer, C.; Finnis, M. W.; Koch, C. T.; Rahmati, B.; Rühle, M.; Shih, S.-J.; Sutton, A. P. | Date of Publication (YYYY-MM-DD): 2010 | Title of Journal: Annual Review of Materials Research | Volume: 40 | Start Page: 557 | End Page: 599 | Document Type: Article | ID: 479381.0 |
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Ab initio study of electronic densities of states at copper-alumina interfaces |
Authors: Hashibon, A.; Elsässer, C.; Rühle, M. | Date of Publication (YYYY-MM-DD): 2007-01-03 | Title of Journal: Acta Materialia | Volume: 55 | Start Page: 1657 | End Page: 1665 | Document Type: Article | ID: 319463.0 |
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Bonding of thin Pd films on (100)SrTiO3 substrates: Ab initio density functional theory investigations |
Authors: van Benthem, K.; Elsässer, C.; Rühle, M. | Date of Publication (YYYY-MM-DD): 2005 | Title of Journal: Physical Review B | Volume: 72 | Sequence Number of Article: 125435 | Document Type: Article | ID: 241907.0 |
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Structure at abrupt copper-alumina interfaces: an ab initio study |
Authors: Hashibon, A.; Elsässer, C.; Rühle, M. | Date of Publication (YYYY-MM-DD): 2005 | Title of Journal: Acta Materialia | Volume: 53 | Start Page: 5323 | End Page: 5325 | Document Type: Article | ID: 262776.0 |
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Electronic correlations, magnetism, and structure of Fe-Al subsystems: An LDA+U study |
Authors: Lechermann, F.; Fähnle, M.; Meyer, B.; Elsässer, C. | Date of Publication (YYYY-MM-DD): 2004-04-22 | Title of Journal: Physical Review B | Volume: 69 | Sequence Number of Article: 165116 | Document Type: Article | ID: 125955.0 |
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First-principles analysis of cation segregation at grain boundaries in α-Al2O3 |
Authors: Fabris, S.; Elsässer, C. | Date of Publication (YYYY-MM-DD): 2003-01-08 | Title of Journal: Acta Materialia | Volume: 51 | Issue / Number: 1 | Start Page: 71 | End Page: 86 | Document Type: Article | ID: 112046.0 |
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Segregated light elements at grain boundaries in niobium and molybdenum |
Authors: Janisch, R.; Elsässer, C. | Date of Publication (YYYY-MM-DD): 2003 | Title of Journal: Physical Review B | Volume: 67 | Sequence Number of Article: 224101 | Document Type: Article | ID: 47152.0 |
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Core-hole effects on the ELNES of absorption edges in SrTiO3 |
Authors: van Benthem, K.; Elsässer, C.; Rühle, M. | Date of Publication (YYYY-MM-DD): 2003 | Title of Journal: Ultramicroscopy | Volume: 96 | Start Page: 509 | End Page: 522 | Document Type: Article | ID: 53016.0 |
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Prismatic ς 3 (1 0 -1 0) twin boundary in α- Al2O3 investigated by density functional theory and transmission electron microscopy |
Authors: Fabris, S.; Nufer, S.; Elsässer, C.; Gemming, T. | Date of Publication (YYYY-MM-DD): 2002-10-15 | Title of Journal: Physical Review B | Volume: 66 | Issue / Number: 15 | Sequence Number of Article: 155415 | Document Type: Article | ID: 6661.0 |
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