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
공지 2019/03/21 - 5/30  Seminar Room #1323  Dr. Hyangtag Lim (KIST) and etc.  Spring 2019: Physics Seminar Serises
공지 2019/02/25 - 06/03  Seminar Room 1501  양용수 교수 (Prof. Yongsoo Yang, KAIST) and etc.  Spring 2019: Physics Colloquium
238 Feb. 25 - Jun 3  Rm. 1501 (E6)    Spring 2019: Physics Colloquium file
237 RM. 1323, E6-2    Spring 2019: Physics Seminar Serises file
236 August. 14th (Wed.), 4:00PM,  Rm. 1323, E6  Prof. Nicolas Treps  Quantum Optics, at the heart of quantum metrology and quantum information file
235 2019. 7. 16(화)  Rm. 1323 (E6-2)  Prof. Sidney Nagel  2019 Physics Distinguished Lecture file
234 3 PM, 12 Jun (Wed), 2019  Rm# 1323, E6-2  Dr. Minyoung You  The relation between free and interacting fermionic SPT phases file
233 2016/09/05-12/12 4PM  Natual Scien Bldg.(E6)m #1501  Yeong Kwan Kim 외  Physics Colloquium : 2016 Fall file
232 May 19, 2016 (Thur.) 3PM  May 19, 2016 (Thur.) 3PM,  Dr. Michael Betz, CERN  The CERN Resonant WISP Search: Development, Results and Lesson-Learned
231 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
» 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
229 2014/05/28, PM5  KI Building, Matrix Hall  이웅범 대표이사(LG이노텍)  부품소재산업이 미래다
228 Aug. 4, 2016 (Thu.), 2:30 pm  KAIST Natural Science Building (E6-5), EDU 3.0 Room(1st fl.)  Prof. Argyris Nicolaidis  Relational Logic (with applications to Quantum Mechanics, String Theory, Cosmology, Neutrino Oscillations, Statistical Mechanics)
227 April 4, 2016 (Mon) - April 8, 2016 (Fri)  KAIST Natural Science Building (E6-2), RM #4314  Dr. Fritz Caspers (CERN)  Radio frequency engineering
226 2015/10/14, 6PM  KAIST Munji Campus Supex Hall  이창환 교수 (부산대학교 물리학과)  인터스텔라 영화 속의 물리 file
225 #1323(E6-2. 1st fl.)  Jul. 10th (Mon), 4pm  Dr. Duk Young Kim Los Alamos National Laboratory  “Intertwined Orders in a Heavy-fermion metal” file
224 April 6, 2017 (Thu), 4:00 pm  IBS CAPP seminar room, Creation Hall (3F), KAIST Munji Campus  Prof. Youngjoon Kwon (Yonsei University)  For whom the Belle tolls
223 May 13 (Fri.) 4 PM  E6. #1501(1st fl.)  Dr. Hosub Jin, Dept. of Physics, UNIST  Graphene analogue in (111)- BaBiO3 bilayer heterostructures for topological electronics
222 May 13 (Fri.), 1:30 PM  E6. #1501(1st fl.)  Dr. Young-Woo Son, Dept. of Physics, KIAS  Aperiodic crystals in low dimensions
221 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
220 Apr. 08 (Fri.), 4:00 PM  E6-2. 5st fl. #1501  Dr. Changyoung Kim, SEOUL NATIONAL UNIV.  Spectroscopic studies of iron-based superconductors : what have we learned?
219 Sep. 4 (Tue), 02:30 PM  E6-2. 2st fl. #2502  Dr. Changmin Lee, MIT  Ultrafast time- and angle-resolved photoemission spectroscopy (tr-ARPES) with extreme ultraviolet laser pulses file