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Irish Atomistic Simulation Meeting (6th) Held in the University College Cork on December 17-18, 2001.

机译：爱尔兰原子模拟会议（第6次）于2001年12月17日至18日在科克大学举行。

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The Final Proceedings for Irish Atomistic Simulators' Meeting, 17 December 2001 - 18 December 2001. The following topics were covered during this conference: computational materials science, electronic structure theory, atomic scale simulation, multi-scale modeling, nanotechnology simulation.

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年度 2002
页码 1-11
总页数 11
原文格式 PDF
正文语种 eng
中图分类工业技术 ;
关键词
Computerized simulation; Quantum chemistry; Composite materials; Microelectronics; Nanotechnology; Transition metals; Symposia; Silicon dioxide; Dielectric films; Solids; Abstracts; Metal oxide semiconductors; Hydrogen; Aluminum oxides; Diffusion; Phonons; Absorption; Ireland; Tellurium; Atomic structure; Bosons; Precious metals; Optical pumping; Isotope effect; Ferroelectricity; Molecular dynamics; Foreign reports; Aq f02-05-0816; Density functional theory; Gainnas(Gallium indium nitrogen arsenide); Dna triplexes; Lacuo(Lanthanum copper oxide); First principles simulation; Camno(Calcium manganese oxide); Alkanoates;

机译：计算机模拟;量子化学;复合材料;微电子学;纳米技术;过渡金属;专题讨论会;二氧化硅;介电薄膜;固体;文摘;金属氧化物半导体;氢;氧化铝;扩散;声子;吸收;爱尔兰;碲;原子结构;玻色子;贵金属;光泵浦;同位素效应;铁电性;分子动力学;国外报道; aq f02-05-0816;密度泛函理论; Gainnas（镓铟氮化砷）; Dna三链体; Lacuo（氧化镧铜）;第一原理模拟; Camno（钙锰氧化物）;烷酸盐;

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Irish Atomistic Simulation Meeting (6th) Held in the University College Cork on December 17-18, 2001.

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