Showing results 1 to 13 of 13
Configuration interaction singles based on the real-space numerical grid method: Kohn-Sham versus Hartree-Fock orbitals Kim, Jaewook; Hong, Kwangwoo; Choi, Sunghwan; Hwang, Sang-Yeon; Kim, Woo Youn, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.17, no.47, pp.31434 - 31443, 2015-12 |
Electronic structure calculations of excited states in molecular systems with local exact exchange potential = 정확한 국부교환퍼텐셜을 이용한 분자시스템의 여기상태 전자구조계산link Hong, Kwangwoo; 홍광우; et al, 한국과학기술원, 2016 |
Fano resonance driven novel spin-valve effect Hong, Kwangwoo; Kim, Woo Youn, 2012 NTHU-KAIST-KYOTO Junior Chemist Symposium, NTHU, KAIST, Kyoto university, 2012-02-15 |
Fano resonance driven spin-valve effect through single-molecule magnets coupled to a carbon nanotube Hong, Kwangwoo; Kim, Woo Youn, 제 110차 대한화학회 물리화학분과 하계 심포지움, 대한화학회 물리화학분과, 2012-06-28 |
Fano Resonance-Driven Spin-Valve Effect Using Single-Molecule Magnets Hong, Kwangwoo; Kim, Woo Youn, 2013 Asian Core Winter School, pp.3389 - 3393, KAIST department of chemistry, SNU CMD, KAIST MIRC, 2013-01-28 |
Fano-Resonance-Driven Spin-Valve Effect Using Single-Molecule Magnets Hong, Kwangwoo; Kim, Woo Youn, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.52, no.12, pp.3389 - 3393, 2013-03 |
Feature of Exact Exchange Kohn-Sham Orbitals with Krieger-Li-Iafrate Approximation Kim, Jaewook; Hong, Kwangwoo; Choi, Sunghwan; Kim, Woo Youn, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.36, no.3, pp.998 - 1007, 2015-03 |
Improvement of initial guess via grid-cutting for efficient grid-based density functional calculations Lim, Jaechang; Choi, Sunghwan; Kang, Sungwoo; Kim, Jaewook; Hong, Kwangwoo; Kim, Woo Youn, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.19, pp.1397 - 1403, 2016-10 |
Performance of a DFT code using Lagrange-sinc basis set for ground and excited state calculations: Exact exchange and Multiconfiguration effects Choi, Sunghwan; Hong, Kwangwoo; Kim, Jaewook; Kim, Woo-Youn, The 9th International Conference on Computational Physics, National University of Singapore, 2015-01-07 |
Representation performances of derivatives in Finite Difference Method Choi, Sunghwan; Hong, Kwangwoo; Kim, Woo-Youn, 2014 KAIST-KYOTO-NTHU Junior Chemist Symposium, KAIST, Kyoto University, National Tsing Hua University, 2014-02-11 |
Spin-Dependent Fano Resonance for Large Magnetoresistance Ratio Spin-Valve Device Hong, Kwangwoo; Kim, Woo Youn, Asia-Pacific Conference of Theoretical and Computational Chemistry 6 (APCTCC 6), Postech, KAIST, Sungkyunkwan Univ., 2013-07-11 |
Supersampling method for efficient grid-based electronic structure calculations Ryu, Seongok; Choi, Sunghwan; Hong, Kwangwoo; Kim, Woo Youn, JOURNAL OF CHEMICAL PHYSICS, v.144, no.9, 2016-03 |
Update to ACE-molecule: Projector augmented wave method on lagrange-sinc basis set Kang, Sungwoo; Ryu, Seongok; Choi, Sunghwan; Kim, Jaewook; Hong, Kwangwoo; Kim, Woo Youn, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.644 - 650, 2016-04 |
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