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Browse "CBE-Journal Papers(저널논문)" by Subject density functional theory

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Showing results 1 to 13 of 13

1	Ab Initio Study of the Sodium Intercalation and Intermediate Phases in Na0.44MnO2 for Sodium-Ion Battery Kim, Heejin; Kim, Dong Jun; Seo, Dong-Hwa; Yeom, Min Sun; Kang, Kisuk; Kim, Do Kyung; Jung, Yousung, CHEMISTRY OF MATERIALS, v.24, no.6, pp.1205 - 1211, 2012-03
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	Atomically Thin Interfacial Suboxide Key to Hydrogen Storage Performance Enhancements of Magnesium Nanoparticles Encapsulated in Reduced Graphene Oxide Wan, Liwen F.; Liu, Yi-Sheng; Cho, Eun Seon; Forster, Jason D.; Jeong, Sohee; Wang, Hsiao-Tsu; Urban, Jeffrey J.; et al, NANO LETTERS, v.17, no.9, pp.5540 - 5545, 2017-09
4	Edge-Functionalized Graphene Nanoribbon Chemical Sensor: Comparison with Carbon Nanotube and Graphene Cho, Kyeong Min; Cho, Soo-Yeon; Chong, Sanggyu; Koh, Hyeong-Jun; Kim, Dae Woo; Kim, Jihan; Jung, Hee-Tae, ACS APPLIED MATERIALS & INTERFACES, v.10, no.49, pp.42905 - 42914, 2018-12
5	Heme Cofactor‐Resembling Fe–N Single Site Embedded Graphene as Nanozymes to Selectively Detect H2O2 with High Sensitivity Kim, Min Su; Lee, Junsang; Kim, Hye Su; Cho, Ara; Shim, Kyu Hwan; Le, Thao Nguyen; An, Seong Soo A; et al, ADVANCED FUNCTIONAL MATERIALS, v.30, no.1, 2020-01
6	Highly Enhanced Gas Adsorption Properties in Vertically Aligned MoS2 Layers Cho, Soo-Yeon; Kim, Seon Joon; Lee, Youhan; Kim, Jong-Seon; Jung, Woo-Bin; Yoo, Hae-Wook; Kim, Jihan; et al, ACS NANO, v.9, no.9, pp.9314 - 9321, 2015-09
7	Hydraulic Power Manufacturing for Highly Scalable and Stable 2D Nanosheet Dispersions and Their Film Electrode Application Jeong, Jae-Min; Kang, Heon Gyu; Kim, Hyung-Jin; Hong, Seok Bok; Jeon, Hyeonyeol; Hwang, Sung Yeon; Seo, Donghyuk; et al, ADVANCED FUNCTIONAL MATERIALS, v.28, no.43, pp.1802952 - 1802952, 2018-10
8	N- and B-Codoped Graphene: A Strong Candidate To Replace Natural Peroxidase in Sensitive and Selective Bioassays Kim, Min su; Cho, Seongyeon; Joo, Se Hun; Lee, Junsang; Kwak, Sang Kyu; Kim, Moon Il; Lee, Jinwoo, ACS NANO, v.13, no.4, pp.4312 - 4321, 2019-04
9	Probing Gas Adsorption in MOFs Using an Efficient Ab Initio Widom Insertion Monte Carlo Method Lee, Youhan; Poloni, Roberta; Kim, Jihan, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.37, no.32, pp.2808 - 2815, 2016-12
10	Rational Development of Co-Doped Mesoporous Ceria with High Peroxidase-Mimicking Activity at Neutral pH for Paper-Based Colorimetric Detection of Multiple Biomarkers Phuong Thy Nguyen; Lee, Junsang; Cho, Ara; Kim, Min Su; Choi, Daeeun; Han, Jeong Woo; Kim, Moon Il; et al, ADVANCED FUNCTIONAL MATERIALS, v.32, no.21, pp.2112428, 2022-05
11	Single-Atom Catalysts of Precious Metals for Electrochemical Reactions Kim, Jiwhan; Kim, Hee-Eun; Lee, Hyunjoo, CHEMSUSCHEM, v.11, no.1, pp.104 - 113, 2018-01
12	Sustainable Hydrogen Production from Water Splitting on a Co3O4@LaCoO3Core-Shell Redox Catalyst Lim, Hyun Suk; Kim, Mimkyu; Kim, Yikyeom; Kim, Hyeon Seok; Kang, Dohyung; Lee, Minbeom; Jo, Ayeong; et al, ACS APPLIED ENERGY MATERIALS, v.5, no.7, pp.8437 - 8442, 2022-07
13	Thermodynamics of gas adsorption in MOFs using Ab Initio calculations Poloni, Roberta; Kim, Jihan, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.569 - 572, 2016-04

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