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 2019/09/18 - 12/5  Seminar Room #1323  Prof. David Schuster and etc.  Fall 2019: Physics Seminar Serises
공지 2019/09/02 - 12/09  Seminar Room 1501  이호성 박사 (한국표준과학연구원) and etc.  Fall 2019: Physics Colloquium
81 May 2 (Thu.), 4:00 PM  #1323, E6-2  Prof. Joon Ik Jang  Anomalous optical properties of halide perovskites file
80 October 29 (Tue.), 14:30 PM  #1323, E6-2  Prof. Jörg Wrachtrup  Quantum sensing file
79 October 11 (Thu.), 16:00 PM  #1323, E6-2  Prof. Joung-Real Ahn  Dirac electrons in a graphene quasicrystal file
78 MAR. 26 (TUE), 0300 PM  E6-2. 2st fl. #2501  Prof. Jung Hoon Han  Consideration of thermal Hall effect in frustrated and un-frustrated quantum magnets file
77 DEC. 16~18 (Sun~Tue)  E6-2. 1st fl. #1323  Prof. Keisuke Totsuka  Lectures on 2d Conformal Field Theory file
76 June 14 (THU), 10:00 AM  E6-2, 2nd fl. #2502  Prof. Kenji Toyoda  Phonons and polariton-like particles in trapped ions for quantum computation and quantum simulation file
75 October 24 (Wed.), 10:30 AM  E6-1, Lecture Room 1501(1F)  Prof. Kerry J. Vahala  Photonic integration of next-generation clocks and Hertz-absolute-accuarcy optical frequenncy synthesizers file
74 May 9 (Thu.), 16:00 PM  #1323, E6-2  Prof. Kwang Geol Lee  Quantum Optical Sensing Using Single Photons And Single Photon Emission from Single Emitters file
73 May 9 (Thu.), 16:00 PM  #1323, E6-2  Prof. Kwang Geol Lee  Quantum Optical Sensing Using Single Photons And Single Photon Emission from Single Emitters file
72 November 28 (Thu.), 16:00 PM  #1323, E6-2  Prof. Kyung Taec Kim  Generation of coherent EUV emissions using ultrashort laser pulses file
71 Apr. 19(Tue.), 2PM  #1323(E6-2. 1st fl.)  Prof. Mark Koepke, Department of Physics and Astronomy, West Virginia University, USA  Nonlocal collisional electron transport in partially ionized plasma generation, structure, and stability
70 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
69 Nov. 10th(Thu) 4 p.m.  E6-2. #1323(1st fl.)  Prof. Min Seok Jang, Electrical Engineering, KAIST  Low Dimensional Active Plasmonics and Electron Optics in Graphene
68 2015/06/03, 12PM  Room 101, E11  Prof. Min-Kyo, Seo & Hansuek, Lee(KAIST)  The First Wednesday Multidisciplinary Forum file
67 June 4 (Tue.), 5:00 PM  #1323, E6-2  Prof. Minsu Kim  Stochastic nature of bacterial eradication using antibiotics file
66 DEC. 27 (Thu), 04:00 PM  E6-2. 1st fl. #1323  Prof. Na Young Kim  Quantum Innovation (QuIN) Laboratory file
65 October 17 (Thu.), 16:00 PM  #1323, E6-2  Prof. Namkyoo Park  Top down manipulation of Waves : From Metamaterials, Correlated Disorder, Quantum Analogy, to Digital Processing file
64 August. 14th (Wed.), 4:00PM,  Rm. 1323, E6  Prof. Nicolas Treps  Quantum Optics, at the heart of quantum metrology and quantum information file
63 Aug. 16 (Wed.), 4 PM  #1322 (E6-2. 1st fl.)  Prof. Noejung Park (UNIST)  Phonon-driven spin-Floquet valleytro-magnetism file
62 October 15 (Tue.), 16:00 PM  #1323, E6-2  Prof. Pilkyung Moon  Moiré superlattices and graphene quasicrystal file