...量子计算化学 分子模拟 介观层次 对接技术 复杂体系 [gap=1184]Keywords computational molecular science, quantum computational chemistry, molecular simulation, mesoscale, bridge technique, complex systems 2 ..
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量子化学计算 quantum chemistry calculation ; quantum chemical computation ; EHMO
计算量子化学 [物化] Computational Quantum Chemistry
量子化学计算法 Computational approach of quantum chemistry
量子化学计算方法 Quantum Chemistry
量子化学计算软件 HyperChem
量子化学计算模型 quantum-chemical computational model
量子有机化学计算 calculation of quantum organic chemistry
计算量子化学分析 computational quantum chemical analysis
他已经发明了一种算法，通过量子计算机在一定程度上精确的模拟化学，这种精确程度是传统计算机永远不能匹敌的。
He has created an algorithm that allows quantum computers to simulate chemistry with a level of accuracy that traditional computers will never be able to match.
量子化学计算机模型已经建立，这是一种十分强大的技术手段，可让化学工程师制造出某种设备，以达到从原子水平上控制化学反应的目的。
Powerful tools such as quantum-chemical computational models allow chemical engineers to build structures that can control reactions at the atomic level.
伏安曲线和量子化学计算分别用来研究方铅矿表面的阳极氧化和氧化过程中电子转移的微观机制。
The surface oxidation of galena and the micro-process of electron transfer involved in the oxidation have been stu died through voltammetry and quantum chemical calculation.
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