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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(, 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 2017/09/14 - 12/07  Seminar Room #1323  Prof. 정광용 교수(Gacheon Univ) and etc.  Fall 2017: Physics Seminar Serises
공지 2017/09/04 - 12/04  Seminar Room 1501  Prof. Sangsu Bae(Hanyang Univ.) and etc.  Fall 2017: Physics Colloquium
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73 5월 17일(화), 11:00 ~ 12:00  창의학습관(E11), 406호  방준혁 박사(Korea Basic Science Institute, KBSI)  The CERN Resonant WISP Search: Development, Results and Lesson-Learned
72 May 19, 2016 (Thur.) 3PM  May 19, 2016 (Thur.) 3PM,  Dr. Michael Betz, CERN  The CERN Resonant WISP Search: Development, Results and Lesson-Learned
71 May 16, 2016 (Mon) 4PM  #1323(E6-2, 1st Fl.)  Dr. Daniel Bowring , Fermi National Accelerator Laboratory  Tuning microwave cavities with biased nonlinear dielectrics for axion searches
70 May 13 (Fri.), 1:30 PM  E6. #1501(1st fl.)  Dr. Young-Woo Son, Dept. of Physics, KIAS  Aperiodic crystals in low dimensions
69 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
68 May 11 (Wed.), 4 PM  E6-2. #1323(1st fl.)  Dr. Bumjoon Kim, Max Planck Institute for Solid State Research  The quest for novel high-temperature superconductors---Prospects and progress in iridates
67 Apr. 28 (Thu.) 3PM  #2501(E6-2. 2nd fl.)  Dr. Chang Hee Sohn, SEOUL NATIONAL UNIVERSITY  Lattice/Spin/Charge Coupling in 5d Pyrochlore Cd2Os2O7
66 April 26 (Tue), 4PM  #1323(1st Floor. E6-2)  Dr. Myung-Ho Bae, Korea Research Institute of Standards and Science  Transport spectroscopy for electronic bands in carbon-based nanomaterials with weak-bond contacts
65 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
» 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
63 Apr. 12 (Tue.), 4 PM  E6-2. 1st fl. #1323  Dr. Jeehoon Kim, POSTECH  Confinement of Superconducting Vortices in Magnetic Force Microscopy
62 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?
61 Apr. 08 (Fri.), 13:30 PM  E6-2. 1st fl. #1501  Dr. Yunkyu Bang, Chonnam National Univ.  Theoretical Overview of Iron-based superconductors and its future
60 Apr. 5 (Tue.), 4PM  E6-2. 1st fl. #1322  Dr. Ara Go, Columbia University  A new impurity solver for multi-orbital systems: adaptive truncation of the Hilbert space
59 Apr. 01 (Fri.) 4:15 PM  E6-2. 1st fl. #1501  Dr. JONG SOO LIM, KIAS  Cotunneling drag effect in Coulomb-coupled quantum dots
58 Apr. 01 (Fri.) 2:30 PM  E6-2. 1st fl. #1501  Dr. KICHEON KANG, Chonnam National University  Interference of single charged particles without a loop and dynamic nonlocality
57 April 6, 2016 (Wed), 3:30 PM  E6-2, RM #1323  Dr. Andrei Matlashov (Los Alamos National Laboratory)  Superconducting Quantum Interference Devices for Precision Detection
56 April 4, 2016 (Mon) - April 8, 2016 (Fri)  KAIST Natural Science Building (E6-2), RM #4314  Dr. Fritz Caspers (CERN)  Radio frequency engineering
55 2016/03/11-06/09  E6-2, 1501 외  박권(KAIS) 외  Physics Seminar Serises : 2016 Spring file