| 56921 | Density functional theory for accurate potential energy surfaces. Kim, Woo Youn, The international chemical congress of Pacific basin societies 2015, Pacifichem, Inc., 2015-12-18 |
| 56922 | Density functional theory for electrochemical energy storage 정유성, 제 116차 대한화학회 물리화학분과 하계 심포지움, 대한화학회, 2014-06-26 |
| 56923 | Density functional theory for electrochemical energy storage: Insights into the cathode materials 정유성, KIST Battery Workshop, KIST, 2015-02-13 |
| 56924 | Density functional theory in classical explicit solvents: Mean-field QM/MM method for simulating solid-liquid interfaces Jang, Taehwan; Paik, Dooam; Shin, Seung-Jae; Kim, Hyungjun, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.43, no.4, pp.476 - 483, 2022-04 |
| 56925 | Density functional theory plus dynamical mean-field theory with natural atomic orbital projectors Sim, Jae-Hoon; Han, Myung Joon, PHYSICAL REVIEW B, v.100, no.11, pp.115151, 2019-09 |
| 56926 | Density Functional Theory Studies of NO and NO2 Adsorption on Al2O3 Supported SnO2 Cluster Liu, Zhiming; Li, Junhua; Woo, Seong Ihl; Hu, Hao, CATALYSIS LETTERS, v.143, no.9, pp.912 - 918, 2013-09 |
| 56927 | Density Functional Theory Studies of Oxygen Affinity of Small Au Nanoparticles Ha, Hyunwoo; Shin, Kihyun; Kim, Hyun You, KOREAN JOURNAL OF MATERIALS RESEARCH, v.27, no.4, pp.229 - 235, 2017-04 |
| 56928 | Density functional theory studies of the [2]Rotaxane component of the Stoddart-Heath molecular switch Jang, YH; Hwang, SG; Kim, Yong-Hoon; Jang, SS; Goddard, WA, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.126, no.39, pp.12636 - 12645, 2004-10 |
| 56929 | Density functional theory studies of TiO2 for photocatalysis and Li storage applications Kim, Yong-Hoon; Choi Ji Il; Lee Dong Ki; Lee Gyu Heon; Kang Jeung Ku, APS March Meeting 2017, American Physical Society, 2017-03-15 |
| 56930 | Density functional theory studies on electrochemical CO2 activation pathways under solvation effect = 밀도범함수 이론을 활용한 용매화 효과 내에서의 이산화탄소 활성화 반응 경로 연구link Lim, Hyung-Kyu; 임형규; et al, 한국과학기술원, 2014 |
| 56931 | Density functional theory study of acetonitrile - Water clusters: Structures and infrared frequency shifts Ahn D.-S.; Lee S., BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.28, no.5, pp.725 - 729, 2007-05 |
| 56932 | Density functional theory study of catalytic reaction at interfacial boundaries and molecular dynamics study on relaxations in viscous fluids = 밀도범함수 이론을 통한 계면 촉매 반응 연구 및 점성 유체 내 동적 완화에 대한 분자동력학 연구link Kim, Kang-Sahn; Lee, Eok Kyun; et al, 한국과학기술원, 2019 |
| 56933 | Density Functional Theory Study of Competitive Reaction Pathways of Ti+ with Fluorinated Acetone in the Gas Phase Hong, Kiryong; Kim, Tae Kyu, JOURNAL OF THE KOREAN CHEMICAL SOCIETY-DAEHAN HWAHAK HOE JEE, v.56, no.1, pp.14 - 19, 2012-02 |
| 56934 | Density Functional Theory Study of MoS2 Monolayer Conjugated by Thiolated Ligands Kim, Jihan; Kwon, Ohmin, The 8th International Conference on Separation Science and Technology, ICSST2016, 2016-07-06 |
| 56935 | Density functional theory study of redox pairs. 1. Dinuclear iron complexes that undergo multielectron redox reactions accompanied by a reversible structural change Baik, Mu-Hyun; Ziegler, T; Schauer, CK, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.122, no.38, pp.9143 - 9154, 2000-09 |
| 56936 | Density functional theory study of redox pairs: 2. Influence of solvation and ion-pair formation on the redox Behavior of cyclooctatetraene and nitrobenzene Baik, Mu-Hyun; Schauer, CK; Ziegler, T, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.124, no.37, pp.11167 - 11181, 2002-09 |
| 56937 | Density Functional Theory Study of Synergistic Gas Sensing Using an Electrically Conductive Mixed Ligand Two-Dimensional Metal-Organic Framework Kang, Shinyoung; Jeon, Mingyu; Kim, Jihan, ACS SENSORS, v.8, no.9, pp.3448 - 3457, 2023-08 |
| 56938 | Density functional theory study of the geometry, energetics, and reconstruction process of Si(111) surfaces Solares S.D; Dasgupta S; Schultz P.A; Kim, Yong-Hoon; Musgrave C.B; Goddard III W.A, LANGMUIR : THE ACS JOURNAL OF SURFACES AND COLLOIDS, v.21, no.26, pp.12404 - 12414, 2005-12 |
| 56939 | Density Functional Theory를 이용한 Doped Rutile TiO2의 CO산화 촉매반응에 대한 연구 Lee, Hyuck Mo, Korean Journal of Metal and Materials, 2008-04-25 |
| 56940 | Density Functional Theory를 이용한Rutile-TiO2(110) supported metal oxide 촉매에서 일어나는 메탄올의 탈수소화반응에 대한 연구 Lee, Hyuck Mo, Korean Journal of Metal and Materials, 2008-10-24 |
