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Coordination action in the Priority Program 1243

Coordination action in the Priority Program 1243
优先计划 1243 中的协调行动
批准号:
25002279
负责人:
Professor Dr. Thomas Frauenheim
金额:
$0.0万
依托单位国家:
德国
项目类别:
Priority Programmes
财政年份:
2006
资助国家:
德国
项目状态:
已结题
起止时间:
2005-12-31 至 2012-12-31

项目摘要

项目成果

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中文摘要
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英文摘要
The Priority Program QUANTRANS aims to form a multidisciplinary collaborative consortium of experimental and theoretical research groups at the interface between physics, chemistry and engineering science to address challenging tasks of the new emerging field of Molecular Electronics. In order to achieve the main goal for developing a full physical picture of molecular-scale charge transport and to study and explore single molecules as new functional device units collaborative research has to meet a new quality. In particular, this concerns a professional coordinative action to provide the involved research groups a professional organizational infrastructure for network formation and integration, for education and training and for scientific exchange and collaboration on the national and international level.The Priority Program aims to form sub-topical (materials system) related research teams which by joined experimental and theoretical effort improve reproducibility in chemical bonding contact geometries and conformation of molecules and theoretical understanding of related quantum electronic transport regimes and mechanisms. In order to gain synergy, the participating groups in strongly interactive collaboration have to define and combine common systems/molecules, related experimental and analyzing techniques, and theoretical methodologies and approaches. The groups have to meet regularly for exchange of expertise on the national level and they have to incorporate the most advanced developments in collaboration with partners from all over the world. Together with presentation of research at international conferences abroad and organized by the PP and via an active internet portal (www.quantrans.de) the groups in the Priority Program will push and lead the formation of an international scientific network in the field of research.
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Atomistic Design of Thermal and Electrical Transport in Materials with Dislocations: From High Power Electronics to Thermoelectrics
Defect calculations in Ga-based semiconductors using optimal hybrid functionals
Charge transport modelling in silicon ultra-scaled devices with native oxide (SINOXI)
Multi-scale approach for prediction of electrical properties of carbon nanotube reinforced polymers
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