Development of Online Quantum Chemistry Experiment Environment Based on Computational Science Platform
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Jeon, Inho
(Div. of National Supercomputing, Korea Institute of Science and Technology Information (KISTI))
On, Noori (Div. of National Supercomputing, Korea Institute of Science and Technology Information (KISTI)) Kwon, Yejin (Div. of National Supercomputing, Korea Institute of Science and Technology Information (KISTI)) Seo, Jerry H. (Div. of National Supercomputing, Korea Institute of Science and Technology Information (KISTI)) Lee, Jongsuk Ruth (Div. of National Supercomputing, Korea Institute of Science and Technology Information (KISTI)) |
1 | Seokmin Shin, et al. "Development and Application of Simulation Software for Education and Research in Computational Chemistry", Final Report, July 2017. |
2 | Hoon Ryu, Junglok Yu, Du seok Jin, Jun-Hyung Lee, Dukyun Nam, Jong-Suk Ruth Lee, Kumwon Cho, Heejung Byun, and Ok-Hwan Byeon, "EDISON Science Gateway: A Cyber-Environment for Domain-Neutral Scientific Computing", IEICE Transactions 97-D, Vol.8, pp.1953-1964, 2014. |
3 | EDISON (EDucation-research Integration through Simulation On the Net, https://www.edison.re.kr) |
4 | EDISON-CHEM (https://chem.edison.re.kr) |
5 | Young Kyoon Suh, "Construction and Service of a Web-based Cyber-learning Platform for the Computational Science and Engineering Community in Korea", Journal of Internet Computing and Services Vol. 17, No. 4, pp. 115-126, Aug. 2016. https://doi.org/10.7472/jksii.2016.17.4.115 DOI |
6 | Inho Jeon et al., "Construction and Service of a Webbased Simulation software management system for the Computational Science and Engineering", Journal of Internet Computing and Services Vol. 18, No. 4, pp. 99-108, Aug. 2017. https://doi.org/10.7472/jksii.2017.18.4.99 DOI |
7 | Gaussian, https://gaussian.com |
8 | Jaguar, https://www.schrodinger.com/jaguar |
9 | Q-Chem, www.q-chem.com |
10 | GAMESS, https://www.msg.chem.iastate.edu/gamess |
11 | ACE-Molecule, https://gitlab.com/aceteam.kaist/ACE-Molecule |
12 | WebMO, https://www.webmo.net |
13 | Liferay, http://www.liferay.com |
14 | Jongsuk R. Lee, et al. "Research and Development (R&D) of the EDISON (EDucation-research Integration through Simulation On the Net) platform and Its User Service on Cyber-Infrastructure", Report of the 2nd (overall 9th) year R&D in the 4th phase, January 2020. |
15 | Kwon, Yejin, et al. "Interface Development for Pre and Post processor on EDISON Platform Simulation System." Journal of Internet Computing and Services Vol. 21, No. 1, pp. 103-110, Feb. 2020, https://doi.org/10.7472/jksii.2016.17.4.115 DOI |
16 | Wikipedia, s.v. "List of quantum chemistry and solidstate physics software" last modified May 29, https://en.wikipedia.org/wiki/List_of_quantum_chemistry_and_solid-state_physics_software |
17 | ACE-Molecule, EDISON SW, https://www.edison.re.kr/scienceappstore/- /scienceapp/KDFT/2-0-3/view |
18 | ACE_UV_analysis, EDISON SW, https://www.edison.re.kr/scienceappstore/-/scienceapp/ACE_UV_analysis/1-0-0/view |
19 | K-EHT, EDISON SW, https://www.edison.re.kr/scienceappstore/-/scienceapp/K-EHT/1-0-0/view |
20 | tdLagChem, EDISON SW, https://www.edison.re.kr/scienceappstore/-/scienceapp/tdLagChem/1-0-0/view |
21 | LagChem, EDISON SW, https://www.edison.re.kr/scienceappstore/-/scienceapp/LagChem/1-0-0/view |
22 | Shin, Jung-Hun, et al. "Workflow-based Environment and its Use Scenario for the Education of Connective Engineering Simulation", Journal of Engineering Education Research, Vol. 21, Issue 6, pp. 3-12, Nov. 2018 DOI |
23 | Ngl.js, https://github.com/arose/ngl |
24 | JSMol, http://jmol.sourceforge.net |
25 | EDISON CHEM e-learning, https://elearning.edison.re.kr/chem |
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