Browse "CH-Conference Papers(학술회의논문)" by Author Choi, Sunghwan
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| Acceleration of evaluation of Hartree Potential via Heterogeneous computing with Graphical Process Units and Many Integrated Cores Choi, Sunghwan; Kwon, Oh Kyoung; Kim, Jaewook; Kim, Woo Youn, The seventh asia-pacific conference of theoretical and computational chemistry, National Tsing Hua University, 2016-01-27 |
| Capturing Carbon Dioxide with Boron Nitride Nanotube with Antisites Choi, Sunghwan; Park, Young C.; Kim, Yong-Hyun; Lee, Yoon Sup; Kim, Woo Youn, 2013 Asian Core Winter School, KAIST department of chemistry, SNU CMD, KAIST MIRC, 2013-01-28 |
| Carbon Dioxide on Carbon Substituted Boron Nitride Nanotube (BNNT) Choi, Sunghwan; Park, Young Choon; Kim, Yong-Hyun; Lee, Yoon Sup; Kim, Woo Youn, Asia-Pacific Conference of Theoretical and Computational Chemistry 6 (APCTCC 6), Postech, KAIST, Sungkyunkwan Univ., 2013-07-12 |
| Characteristic of Kohn-Sham orbitals obtained by Krieger-Li-Iafrate approximation and its application to excited state calculation Kim, Jaewook; Hong, Kwang-Woo; Choi, Sunghwan; Hwang, Sang-Yeon; Kim, Woo Youn, IUPAC-2015, Korean Chemical Society, 2015-08-13 |
| Configuration interaction singles and doubles using exact exchange kohn sham orbital in real- space grid method LIM, JAE; Kim, Jaewook; Choi, Sunghwan; Kim, Woo Youn, 11th Triennial Congress of the World Association of Theoretical and Computational Chemists, Ludwig-Maximilians-Universität (LMU), 2017-08-29 |
| Configuration interaction singles and doubles using Kohn-Sham orbitals with local exchange potential Lim, Jaechang; Choi, Sunghwan; Kim, Jaewook; Kim, Woo Youn, 4th Conference on Theory and Applications of Computational Chemistry, University of Washington, 2016-08-30 |
| Configurational Interaction method using Kohn-Sham Orbitals for the real-space numerical grid based DFT program Kim, Jaewook; Lim, Jaechang; Hong, Kwang Woo; Choi, Sunghwan; Hwang, Sang Yeon; Kim, Woo Youn, The seventh asia-pacific conference of theoretical and computational chemistry, National Tsing Hua University, 2016-01-27 |
| Development of a DFT code using Lagrange-sinc functions as a basis set and its numerical accuracy Choi, Sunghwan; Hong, Kwang-Woo; Kim, Jaewook; Kim, Woo-Youn, 19th International Workshop on Quantum Systems in Chemistry, Physics and Biology (QSCP-XIX), Tamkang University, 2014-11-12 |
| Developments of electronic structure calculation program 'ACE-Molecule' : Implementations of supersampling method and geometry optimization Rheu, Seongok; Choi, Sunghwan; Hong, Kwang Woo; Kim, Jaewook; Kang, Sungwoo; Hwang, Sang Yeon; LIM, JAE; et al, 제 12회 고등과학원 전자구조계산학회, 고등과학원, 2016-06-16 |
| Efficient Basin-Hopping Sampling of Reaction Intermediates Through Fragmented Molecules Kim, Yeon Joon; Choi, Sunghwan; Kim, Woo-Youn, Asian CORE Winter School on Frontiers of Molecular, Photo-, and Material Sciences, Institute of Atomic and Molecular Sciences, Academia Sinica, 2014-02-24 |
| Efficient graph-based method for finding reaction pathways through stochastic and deterministic intermediate samplings Kim, Yeonjoon; Choi, Sunghwan; Kim, Jin Woo; Kim, Jihyo; Kim, Woo Youn, 4th Conference on Theory and Applications of Computational Chemistry, University of Washington, 2016-08-30 |
| Efficient method for automated prediction of reaction paths through graph-theoretic analysis Kim, Yeonjoon; Kim, JinWoo; Choi, Sunghwan; KIM, ZEEHYO; Kim, Woo Youn, 제 124차 물리화학분과회 하계 심포지엄 &한일 분자과학 심포지엄, 대한화학회 물리분과회, 2017-07-11 |
| Efficient method for sampling intermediates of chemical reactions: Basin-hopping with molecular fragmentation and graph theory Kim, Yeon Joon; Choi, Sunghwan; Kim, Woo-Youn, IUPAC-2015, Korean Chemical Society, 2015-08-10 |
| Efficient Sampling of Reaction Intermediates Using Basin-Hopping with Molecular Fragmentation and Graph Theory Kim, Yeonjoon; Choi, Sunghwan; Kim, Woo Youn, 제116차 대한화학회 물리화학분과 하계 심포지움, 대한화학회 물리화학분과, 2014-06-26 |
| Features of local exact exchange functional in hybrid functionals for excited state calculation with time-dependent density functional theory Kim, Jaewook; Hong, Kwang Woo; Hwang, Sang Yeon; Rheu, Seongok; Choi, Sunghwan; Kim, Woo Youn, 제 12회 고등과학원 전자구조계산학회, 고등과학원, 2016-06-16 |
| Implementation of Lagrange function-based density functional theory and its applications Choi, Sunghwan; Hong, Kwang-Woo; Kim, Jaewook; Kim, Woo-Youn, 10th Triennial Congress of the World Association of Theoretical and Computational Chemists(WATOC 2014), Pontificia Universidad Católica de Chile, 2014-10-07 |
| Importance of local exact exchange potential in hybrid functionals for accurate excited states Kim, Jaewook; Hong, Kwang-Woo; Sungwoo, Kang; LIM, JAE; Hwang, Sang-Yeon; Ryu, Seongok; Choi, Sunghwan; et al, 11th Triennial Congress of the World Association of Theoretical and Computational Chemists, Ludwig-Maximilians-Universität (LMU), 2017-08-29 |
| Investigation of Chemical Applicability of Lagrange-sinc basis for Density Functional Calculations Hong, Kwang-Woo; Choi, Sunghwan; Kim, Jaewook; Kim, Woo-Youn, Hands-on Summer School: Electronic Structure Theory for Materials and (Bio)molecules, UCLA Institue for Pure & Applied Mathematics, 2014-07-21 |
| Investigation of Lagrange-sinc Function as Basis Set for Density Functional Theory in terms of Chemical Accuracy Choi, Sunghwan; Hong, Kwang-Woo; Kim, Jaewook; Kim, Woo-Youn, Current Topics in Theoretical Chemistry 2014, International academy of quantum molecular science, 2014-08-25 |
| Massively Parallelized Evaluation of Orbital Dependent Exchange Potential in Real Space Formula Choi, Sunghwan; Hong, Kwang-Woo; Kim, Jaewook; Kim, Woo-Youn, IUPAC-2015, Korean Chemical Society, 2015-08-13 |
| Modification of Lanczos method for high fidelity and scalability for electronic structure calculations Choi, Sunghwan; Kim, Woo Youn; Ryu, Hoon, The 57th Sanibel Symposium, University of Florida, 2017-02-21 |
| New way of making initial guess for Iterative Self Consistent Field Procedure in Grid based method Lim, Jaechang; Choi, Sunghwan; Kang, Sungwoo; Hong, Kwang-Woo; Kim, Woo-Youn, IUPAC-2015, Korean Chemical Society, 2015-08-13 |
| Numerical accuracy of Lagrange-sinc basis set for atoms and molecules in density functional calculations Hong, Kwang-Woo; Choi, Sunghwan; Kim, Jaewook; Kim, Woo-Youn, IUPAC-2015, Korean Chemical Society, 2015-08-13 |
| 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 |
| Performance of Range-Separated Hybrid Functional with Krieger-Li-Iafrate Potential for Molecular Excitation Energies Sungwoo, Kang; Kim, Jaewook; Choi, Sunghwan; LIM, JAE; Hwang, Sang-Yeon; Ryu, Seongok; Kim, Woo Youn, 11th Triennial Congress of the World Association of Theoretical and Computational Chemists, Ludwig-Maximilians-Universität (LMU), 2017-08-29 |
| 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 |
| Role of local exact exchange potential in hybrid functionals for accurate excited state calculations Kim, Jaewook; Hong, Kwang Woo; Hwang, Sang Yeon; Rheu, Seongok; Choi, Sunghwan; Kim, Woo Youn, 4th Conference on Theory and Applications of Computational Chemistry, University of Washington, 2016-08-30 |
| Supersampling double grid method to improve accuracy of real space electronic structure calculation Ryu, Seongok; Choi, Sunghwan; Hong, Kwang-Woo; Kim, Woo-Youn, IUPAC-2015, Korean Chemical Society, 2015-08-13 |
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