Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia
Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these...
Ausführliche Beschreibung
Gespeichert in:
| Autor*in: |
Andrés, J. [verfasserIn] |
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| Format: |
Artikel |
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| Sprache: |
Englisch |
| Erschienen: |
1995 |
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| Schlagwörter: |
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| Anmerkung: |
© Chapman & Hall 1995 |
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| Übergeordnetes Werk: |
Enthalten in: Journal of materials science - Kluwer Academic Publishers-Plenum Publishers, 1966, 30(1995), 19 vom: Okt., Seite 4852-4856 |
|---|---|
| Übergeordnetes Werk: |
volume:30 ; year:1995 ; number:19 ; month:10 ; pages:4852-4856 |
| Links: |
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| DOI / URN: |
10.1007/BF01154494 |
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| 520 | |a Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. | ||
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| 650 | 4 | |a Tetragonal Structure | |
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| 700 | 1 | |a Moliner, V. |4 aut | |
| 700 | 1 | |a Longo, E. |4 aut | |
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10.1007/BF01154494 doi (DE-627)OLC2046221389 (DE-He213)BF01154494-p DE-627 ger DE-627 rakwb eng 670 VZ Andrés, J. verfasserin aut Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia 1995 Text txt rdacontent ohne Hilfsmittel zu benutzen n rdamedia Band nc rdacarrier © Chapman & Hall 1995 Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. Polymer Zirconia Energy Barrier Y2O3 Tetragonal Structure Beltrán, A. aut Moliner, V. aut Longo, E. aut Enthalten in Journal of materials science Kluwer Academic Publishers-Plenum Publishers, 1966 30(1995), 19 vom: Okt., Seite 4852-4856 (DE-627)129546372 (DE-600)218324-9 (DE-576)014996774 0022-2461 nnns volume:30 year:1995 number:19 month:10 pages:4852-4856 https://doi.org/10.1007/BF01154494 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_OLC SSG-OLC-TEC GBV_ILN_11 GBV_ILN_20 GBV_ILN_23 GBV_ILN_24 GBV_ILN_30 GBV_ILN_32 GBV_ILN_40 GBV_ILN_62 GBV_ILN_65 GBV_ILN_70 GBV_ILN_2004 GBV_ILN_2006 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_4082 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4316 GBV_ILN_4319 GBV_ILN_4323 GBV_ILN_4700 AR 30 1995 19 10 4852-4856 |
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10.1007/BF01154494 doi (DE-627)OLC2046221389 (DE-He213)BF01154494-p DE-627 ger DE-627 rakwb eng 670 VZ Andrés, J. verfasserin aut Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia 1995 Text txt rdacontent ohne Hilfsmittel zu benutzen n rdamedia Band nc rdacarrier © Chapman & Hall 1995 Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. Polymer Zirconia Energy Barrier Y2O3 Tetragonal Structure Beltrán, A. aut Moliner, V. aut Longo, E. aut Enthalten in Journal of materials science Kluwer Academic Publishers-Plenum Publishers, 1966 30(1995), 19 vom: Okt., Seite 4852-4856 (DE-627)129546372 (DE-600)218324-9 (DE-576)014996774 0022-2461 nnns volume:30 year:1995 number:19 month:10 pages:4852-4856 https://doi.org/10.1007/BF01154494 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_OLC SSG-OLC-TEC GBV_ILN_11 GBV_ILN_20 GBV_ILN_23 GBV_ILN_24 GBV_ILN_30 GBV_ILN_32 GBV_ILN_40 GBV_ILN_62 GBV_ILN_65 GBV_ILN_70 GBV_ILN_2004 GBV_ILN_2006 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_4082 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4316 GBV_ILN_4319 GBV_ILN_4323 GBV_ILN_4700 AR 30 1995 19 10 4852-4856 |
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10.1007/BF01154494 doi (DE-627)OLC2046221389 (DE-He213)BF01154494-p DE-627 ger DE-627 rakwb eng 670 VZ Andrés, J. verfasserin aut Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia 1995 Text txt rdacontent ohne Hilfsmittel zu benutzen n rdamedia Band nc rdacarrier © Chapman & Hall 1995 Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. Polymer Zirconia Energy Barrier Y2O3 Tetragonal Structure Beltrán, A. aut Moliner, V. aut Longo, E. aut Enthalten in Journal of materials science Kluwer Academic Publishers-Plenum Publishers, 1966 30(1995), 19 vom: Okt., Seite 4852-4856 (DE-627)129546372 (DE-600)218324-9 (DE-576)014996774 0022-2461 nnns volume:30 year:1995 number:19 month:10 pages:4852-4856 https://doi.org/10.1007/BF01154494 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_OLC SSG-OLC-TEC GBV_ILN_11 GBV_ILN_20 GBV_ILN_23 GBV_ILN_24 GBV_ILN_30 GBV_ILN_32 GBV_ILN_40 GBV_ILN_62 GBV_ILN_65 GBV_ILN_70 GBV_ILN_2004 GBV_ILN_2006 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_4082 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4316 GBV_ILN_4319 GBV_ILN_4323 GBV_ILN_4700 AR 30 1995 19 10 4852-4856 |
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10.1007/BF01154494 doi (DE-627)OLC2046221389 (DE-He213)BF01154494-p DE-627 ger DE-627 rakwb eng 670 VZ Andrés, J. verfasserin aut Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia 1995 Text txt rdacontent ohne Hilfsmittel zu benutzen n rdamedia Band nc rdacarrier © Chapman & Hall 1995 Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. Polymer Zirconia Energy Barrier Y2O3 Tetragonal Structure Beltrán, A. aut Moliner, V. aut Longo, E. aut Enthalten in Journal of materials science Kluwer Academic Publishers-Plenum Publishers, 1966 30(1995), 19 vom: Okt., Seite 4852-4856 (DE-627)129546372 (DE-600)218324-9 (DE-576)014996774 0022-2461 nnns volume:30 year:1995 number:19 month:10 pages:4852-4856 https://doi.org/10.1007/BF01154494 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_OLC SSG-OLC-TEC GBV_ILN_11 GBV_ILN_20 GBV_ILN_23 GBV_ILN_24 GBV_ILN_30 GBV_ILN_32 GBV_ILN_40 GBV_ILN_62 GBV_ILN_65 GBV_ILN_70 GBV_ILN_2004 GBV_ILN_2006 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_4082 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4316 GBV_ILN_4319 GBV_ILN_4323 GBV_ILN_4700 AR 30 1995 19 10 4852-4856 |
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10.1007/BF01154494 doi (DE-627)OLC2046221389 (DE-He213)BF01154494-p DE-627 ger DE-627 rakwb eng 670 VZ Andrés, J. verfasserin aut Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia 1995 Text txt rdacontent ohne Hilfsmittel zu benutzen n rdamedia Band nc rdacarrier © Chapman & Hall 1995 Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. Polymer Zirconia Energy Barrier Y2O3 Tetragonal Structure Beltrán, A. aut Moliner, V. aut Longo, E. aut Enthalten in Journal of materials science Kluwer Academic Publishers-Plenum Publishers, 1966 30(1995), 19 vom: Okt., Seite 4852-4856 (DE-627)129546372 (DE-600)218324-9 (DE-576)014996774 0022-2461 nnns volume:30 year:1995 number:19 month:10 pages:4852-4856 https://doi.org/10.1007/BF01154494 lizenzpflichtig Volltext GBV_USEFLAG_A SYSFLAG_A GBV_OLC SSG-OLC-TEC GBV_ILN_11 GBV_ILN_20 GBV_ILN_23 GBV_ILN_24 GBV_ILN_30 GBV_ILN_32 GBV_ILN_40 GBV_ILN_62 GBV_ILN_65 GBV_ILN_70 GBV_ILN_2004 GBV_ILN_2006 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_4082 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4316 GBV_ILN_4319 GBV_ILN_4323 GBV_ILN_4700 AR 30 1995 19 10 4852-4856 |
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simulation of ionic crystals: calculation of madelung potentials for stabilized zirconia |
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Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia |
| abstract |
Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. © Chapman & Hall 1995 |
| abstractGer |
Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. © Chapman & Hall 1995 |
| abstract_unstemmed |
Abstract By assuming complete ionicity, a theoretical study of structure and energetics in zirconias stabilized by the addition of $ Y_{2} $$ O_{3} $ or MgO, has been reported. The simulation was carried out using the Ewald summation technique. The results indicate that the cubic structures of these ionic crystals are metastable and they transform without an energy barrier to a pseudomonoclinic or tetragonal structure. © Chapman & Hall 1995 |
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Simulation of ionic crystals: calculation of Madelung potentials for stabilized zirconia |
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Beltrán, A. Moliner, V. Longo, E. |
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