生命科学研究部門セミナーを、2月17日（金）に開催します。
多数のご来聴をお願い致します。

日時：2017年2月17日（金） 15:00-16:00
場所：筑波大学　計算科学研究センター　　2F 会議室D
題目：QTAIM Next Generation Quantum Topological Theory
講師：講演者：Samantha Jenkins （湖南師範大学・教授）

要旨:
The seminar will present an overview of the development the new methods including those to elucidate mechanically, thermally and photochemically induced phenomena in molecular devices. We present a new QTAIM and stress tensor interpreted Ramachandran plot and a new method to visualize normal modes. Next generation quantum topological theory will partner existing theory methods and will use their resultant total electronic charge density distributions as input and is suitable for many types of chemical, physical and excited state phenomena; photo-isomerization, excited state intra-molecular and the related avoided crossings and conical intersections of potential energy surfaces. The adaptations of the bonding topology to the functioning of the mechanical, thermal and light driven devices can reveal chemical patterns beyond the scope of the Woodward-Hoffman rules.

世話人：重田育照