关于举行林雪平大学Glib Baryshnikov助理教授、Ihor Sahalianov博士学术报告的通知

2024-04-30 192

报告

编号

报告题目

时间

报告人

1

Advanced strategies for modern OLEDs

10:30-11:30

 

Glib Baryshnikov

2

ChemCraft software for visualization of the quantum chemical simulations

15:00-16:00

3

Computational materials science with COMSOL

16:00-17:00

Ihor Sahalianov

 

邀  请  人:马於光院士

报告时间:5月8号

报告地点:北区科技园1号楼502会议室


欢迎广大师生踊跃参与~~~

 

报告1摘要:

Over the past few decades organic electronics became one of the most important fields of science for the humanity. Huge consumer success and impressive technical abilities of novel electronic devices have resulted in the necessity of further scientific investigations and developments in this field. The significant competitive potential of organic light emitting diodes (OLEDs) and a number of design and technological features, that are unique to this class of devices, have created preconditions for commercialization of OLEDs as basic elements in display technologies, automotive engineering, biomedicine and dynamic lighting systems. My report summarizes some new strategies for development of revolutionary emitters for OLEDs. The “new strategies” involves the usage of organic luminescent radicals (for orange-green region), metal-free phosphors (for red, green, blue regions) and doubly thermally activated delayed fluorescent dyes (for whole visible region) as OLED emitters. The successful implementation of these strategies includes a combination of computational design with organic synthesis, a comprehensive study of newly synthesized materials and the fabrication of devices to make a breakthrough in OLED performance and to support a sustainable development in this field.

 

报告2摘要:

ChemCraft is one of the most functional software for visualization of the results of quantum-chemical simulations. It is compatible with the outputs from most popular computational packages like Gaussian, ORCA, Turbomole, ADF, QChem, VASP etc. During the seminar the most important options of Chemcraft software related to the visualization of structural, spectral, magnetic and electronic properties will be considered based on standard examples for benchmark systems. Also, the basic parts of Gaussian outputs will be discussed in terms of the visualization in ChemCraft.

 

报告3摘要:

Finite element analysis is becoming standard in both industry and academia. The ability to solve partial differential equations at arbitrary geometry subdivided by elements allows simulations of various aspects of experimental studies, from fundamental problems to full-device modeling. COMSOL is one of the (if not the best) commercially available software packages, which implements finite element method coupled with multiphysics modeling. In this lecture, we will look at the capabilities of COMSOl within the current frame of computational materials science. Multiple research projects, dedicated to electrostatics, thermal transport, solid mechanics, and chemistry of diluted species will be discussed.

 

报告人简介:


Glib Baryshnikov2015年博士毕业于乌克兰哈尔科夫大学,指导导师Boris Minae教授;毕业后获得瑞典Carl Trygger基金资助在瑞典皇家理工学院从事博士后研究,合作导师为Hans Ågren2021年加入林雪平大学成为助理教授。他的研究兴趣集中于光学材料及有机发光二极管的理论计算。

 


Ihor Sahalianov2016年获得乌克兰基辅国立塔拉斯舍甫琴科大学(National Taras Shevchenko University of Kyiv)计算物理学博士学位;2018-2020年在瑞典林雪平大学从事博士后研究,2022年在捷克中欧理工学院担任高级研究员,20238月至今为林雪平大学有机电子实验室研究员,研究兴趣为通过Finite Element Analysis (FEA) Density Functional Theory Python (Programming Language)以及 COMSOL等对有机导电聚合物的电容、光谱吸收性能进行理论计算。


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