Электронная структура и термодинамика точечных дефектов в металлах и сплавах из первых принципов
Диссертация
Возросшая производительность современных компьютеров, а также разработка мощных теоретических и вычислительных методов, сделали возможным проведение исследований свойств атомных дефектов «из первых принципов», т. е. путем решения квантовомеханических уравнений для электронов в поле атомных ядер. В настоящее время, первопринципные методы исследования активно применяются для расчета таких свойств… Читать ещё >
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