visual
visual

세미나

  • HOME
  • >
  • 소식
  • >
  • 세미나
장소 KI빌딩(E4), 강의실 B501 (5F) 
일시 4월 18일(월), 15:30~ 
연사 Prof. Robert A. DiStasio Jr. (Cornell University) 

1. 일시: 418(), 15:30~

2. 장소: KI빌딩(E4), 강의실 B501 (5F)

3. 주제: First Principles Approaches for Intermolecular Interactions: From Gas-Phase Dimers to Liquid Water and Molecular Crystal Polymorphism

4. 문의: 이수현(suehyun@kaist.ac.kr, 내선 1752)

5. 주관: 정유성 교수님 (내선 1712)

6. Abstract:

Long-range van der Waals (vdW) or dispersion interactions are crucial in determining the structure, stability, and function of many systems throughout the fields of biology, chemistry, physics, and materials science. In this work, I will discuss several first-principles based approaches that have been recently developed for obtaining an accurate theoretical description of vdW interactions in molecules and materials. Particular focus will be placed on the many-body dispersion (MBD) model, which includes both long-range Coulomb electrodynamic response screening effects as well as a treatment of the many-body vdW energy to infinite order. To demonstrate the increasingly important role played by many-body vdW interactions in large, structurally complex molecular systems, this method will be used to investigate several pertinent molecular properties, such as binding energies/affinities in gas-phase molecular dimers and supramolecular complexes, relative conformational energetics in small polypeptides and DNA helices, anomalous structural and density signatures of liquid water, and thermodynamic stabilities among competing molecular crystal polymorphs.

* 첨부. Abstract 

번호 일시 장소 연사 제목
305 2016/09/29-12/13  E6-2, #1323  Sangyoon Han 외  2016 Fall, Physics Seminar Serises file
304 2016/1/11, 4PM  E6-2, #1323  Dr. B.J.Kim (Max Planck Institute for Solid State Research)  Mott Physics in the Strong Spin-Orbit Coupling Regime
303 2016/1/26, 2PM  E6-2, #1323  Dr. Sergei V. Kalinin (Center for Nanophase Materials Sciences, Oak Ridge National Laboratory)  Electrochemistry on Nano- and Atomic Levels: Scanning Probe Microscopy Meets Deep Data
302 2017.1.9(Mon), 4PM  Lecture Hall, College of Natural Sciences [#1501,E6-2]  Prof. John Michael Kosterlitz, Brown University  Topological Defects and Phase Transitions" file
301 2017/03/06 - 05/29  Seminar Room 1501  이종봉 박사 (POSTECH) 외  Spring 2017: Physics Colloquium file
300 2017/03/21 - 06/08  Seminar Room 1323  조길영 박사(KAIST) 외  Spring 2017: Physics Seminar Serises file
299 2018. 6. 22 10:00am ~ 11:50am  E6-6, Lecture Room 119 (1F)  Prof. Sang Bok Lee, Dept. of Chemistry and Biochemistry, Univ. of Maryland  Success in Research Career file
298 2018년 9월 7일 (금), 3PM  학술문화관 (E9), 2층 양승택 오디토리움  Prof. Martin Head-Gordon, UC Berkeley  Recent developments in density functional theory: From new functionals to the nature of the chemical bond file
297 2019. 7. 16(화)  Rm. 1323 (E6-2)  Prof. Sidney Nagel  2019 Physics Distinguished Lecture file
296 2019. 8. 22 4PM & 8. 23 3PM  #1323, E6-2  Prof. Andrew N Cleland  Physics and Applications in Nanoelectronics and Nonomechanics file
295 2019/09/02 - 12/09  Seminar Room 1501  이호성 박사 (한국표준과학연구원) and etc.  Fall 2019: Physics Colloquium file
294 2019/09/18 - 12/5  Seminar Room #1323  Prof. David Schuster and etc.  Fall 2019: Physics Seminar Serises file
293 3 PM, 12 Jun (Wed), 2019  Rm# 1323, E6-2  Dr. Minyoung You  The relation between free and interacting fermionic SPT phases file
292 3pm, 19th May  online  Jonghee Yoon, PhD (Assistant professor, Department of Physics, Ajou University)  (광학분야 특별세미나)Development of a multimodal optical system for improved disease diagnosis
291 4pm, 10th May  E6 1323  권혁준 (Korea Institute for Advanced Study, KIAS)  (광학분야 특별세미나)Testing quantum thermodynamics using quantum optics
290 4pm, 14th April  E6 1323  신승우 (KAIST 물리학과)  (광학분야 특별세미나)Holographic tomography of dielectric tensors at optical frequency
289 4pm, 28th April  E6 1323  유경식 (KAIST 전기및전자공학부)  (광학분야 특별세미나)Adiabaticity and symmetry in optical waveguide design
288 4pm, 31th March  online  최현용 (서울대학교 물리천문학부)  (광학분야 특별세미나)Ultrafast time-resolved spectroscopy in topological materials
287 4pm, Sep. 21 (Wed.  E6-2. #2502(2nd fl.)  Dr. Henrik Johannesson , University of Gothenburg (Sweden) and Beijing Computational Science Research Center (China)  Entanglement probe of two-impurity Kondo physics
» 4월 18일(월), 15:30~  KI빌딩(E4), 강의실 B501 (5F)  Prof. Robert A. DiStasio Jr. (Cornell University)  First Principles Approaches for Intermolecular Interactions: From Gas-Phase Dimers to Liquid Water and Molecular Crystal Polymorphism file