| 1 | Accelerated purification for density matrix using generalized non-purifying intermediate functions = 정제하지 않는 중간함수를 이용하여 밀도행렬을 빠르게 정제시키는 방법에 대한 연구link Kim, Jae-Hoon; 김재훈; et al, 한국과학기술원, 2012 |
| 2 | Advances in molecular quantum chemistry contained in the Q-Chem 4 program package Shao, Yihan; Gan, Zhengting; Epifanovsky, Evgeny; Gilbert, Andrew T. B.; Wormit, Michael; Kussmann, Joerg; Lange, Adrian W.; et al, MOLECULAR PHYSICS, v.113, no.2, pp.184 - 215, 2015-01 |
| 3 | Analytical Double-Hybrid Density Functional Based on the Polynomial Series Expansion of Adiabatic Connection: A Quadratic Approximation Kim, Jaehoon; Jung, You-Sung, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.11, no.1, pp.45 - 54, 2015-01 |
| 4 | Assessments of Semilocal Density Functionals and Corrections for Carbon Dioxide Adsorption on Metal-Organic Frameworks Ji, Hyunjun; Park, Joonho; Cho, Moses; Jung, You-Sung, CHEMPHYSCHEM, v.15, no.15, pp.3157 - 3165, 2014-10 |
| 5 | Basis set dependence in double hybrid density functional = 이중혼성 밀도 범함수에서 기저계의 의존성 조사link Lim, Ju Hyung; 임주형; et al, 한국과학기술원, 2016 |
| 6 | Combinatorial Screening of Highly Active Pd Binary Catalysts for Electrochemical Oxygen Reduction Lee, Ki-Rak; Jung, You-Sung; Woo, Seong-Ihl, ACS COMBINATORIAL SCIENCE, v.14, no.1, pp.10 - 16, 2012-01 |
| 7 | Critical Role of Crystal Water for a Layered Cathode Material in Sodium Ion Batteries Nam, Kwan Woo; Kim, Sangryun; Yang, Eunjeong; Jung, You-Sung; Levi, Elena; Aurbach, Doron; Choi, Jang-Wook, CHEMISTRY OF MATERIALS, v.27, no.10, pp.3721 - 3725, 2015-05 |
| 8 | Direct observation of atomic hydrogen generated from the water framework of clathrate hydrates Shin, Kyu-Chul; Cha, Min-Jun; Kim, Hyung-Jun; Jung, You-Sung; Kang, Young-Soo; Lee, Huen, CHEMICAL COMMUNICATIONS, v.47, no.2, pp.674 - 676, 2011-01 |
| 9 | Directing the Structural Features of N-2-Phobic Nanoporous Covalent Organic Polymers for CO2 Capture and Separation Patel, Hasmukh A.; Je, Sang Hyun; Park, Joonho; Jung, You-Sung; Coskun, Ali; Yavuz, Cafer T, CHEMISTRY-A EUROPEAN JOURNAL, v.20, no.3, pp.772 - 780, 2014-01 |
| 10 | Effects of boron oxidation state on electrocatalytic activity of carbons synthesized from CO2 Byeon, A Yeong; Park, Joonho; Baik, Seoyeon; Jung, You-Sung; Lee, Jae Woo, JOURNAL OF MATERIALS CHEMISTRY A, v.3, no.11, pp.5843 - 5849, 2015-03 |
| 11 | First principles studies on sodium-ion battery cathode materials = 소듐 이온 전지 양극 재료에 대한 제일원리 계산 연구link Kim, Hee-Jin; 김희진; et al, 한국과학기술원, 2014 |
| 12 | First principles study on solid electrolyte materials for lithium rechargeable batteries = 제일원리계산을 이용한 리튬 이차 전지용 고체 전해질에 관한 연구link Park, In-Chul; 박인철; et al, 한국과학기술원, 2012 |
| 13 | Intramolecular Aromatic Carbenoid Insertion of Biaryldiazoacetates for the Regioselective Synthesis of Fluorenes Kim, Jin-Ho; Ok, You-Hwa; Park, Sae-Hume; Jung, You-Sung; Chang, Suk-Bok, CHEMISTRY-AN ASIAN JOURNAL, v.6, pp.2039 - 2046, 2011-08 |
| 14 | On the mechanism of enhanced oxygen reduction reaction in nitrogen-doped graphene nanoribbons Kim, Hee-Jin; Lee, Ki-Rak; Woo, Seong-Ihl; Jung, You-Sung, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.13, no.39, pp.17505 - 17510, 2011-09 |
| 15 | On the structure of Si(100) surface: Importance of higher order correlations for buckled dimer = Si (100) 비대칭 표면에서 고차원적 상관관계 효과의 중요성link Back, Seo-In; 백서인; et al, 한국과학기술원, 2013 |
| 16 | Predictive materials science from first principles approaches: Atomic understanding of cathode materials Jung, You-Sung, KAIST-DTU Workshop on Next Generation Energy Storage, KAIST, 2012-11-16 |
| 17 | Selective Heterogeneous CO2 Electroreduction to Methanol Back, Seoin; Kim, Hee-Jin; Jung, You-Sung, ACS CATALYSIS, v.5, no.2, pp.965 - 971, 2015-02 |
| 18 | Significant reduction of thermal conductivity in InAs nanotubes = InAs 나노튜브에서의 열전도율 감소link Yi, Su-In; 이수인; et al, 한국과학기술원, 2012 |
| 19 | Site-Specific Transition Metal Occupation in Multicomponent Pyrophosphate for Improved Electrochemical and Thermal Properties in Lithium Battery Cathodes: A Combined Experimental and Theoretical Study Shakoor, Rana. A.; Kim, Hee-Jin; Cho, Woo-Suk; Lim, Soo-Yeon; Song, Han-Nah; Lee, Jung-Woo; Kang, Jeung-Ku; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.134, no.28, pp.11740 - 11748, 2012-07 |
| 20 | Skeletal Octahedral Nanoframe with Cartesian Coordinates via Geometrically Precise Nanoscale Phase Segregation in a Pt@Ni Core-Shell Nanocrystal Oh, Aram; Baik, Hionsuck; Choi, Dong Shin; Cheon, Jae Yeong; Kim, Byeongyoon; Kim, Hee-Jin; Kwon, Seong Jung; et al, ACS NANO, v.9, no.3, pp.2856 - 2867, 2015-03 |
| 21 | Superexchange-Like Interaction of Encaged Molecular Oxygen in Nitrogen-Doped Water Cages of Clathrate Hydrates Shin, Kyu-Chul; Cha, Min-Jun; Lee, Won-Hee; Kim, Hyung-Jun; Jung, You-Sung; Dho, Joong-Hoe; Kim, Jin-Kwon; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.133, no.50, pp.20399 - 20404, 2011-12 |
| 22 | Thermodynamics of water under hydrophilic versus hydrophobic confinement: boron nitride nanotubes with different charge models = 친수성 및 비수성의 제한적 환경 하에서의 물의 열역학: 상이한 전하모델을 적용한 붕소-질소 나노튜브link Yun, Jun-Nyeong; 윤준녕; et al, 한국과학기술원, 2013 |
