Effects of the Zeolite Framework on the Adsorptions and Hydrogen-Exchange Reactions of Unsaturated Aliphatic, Aromatic, and Heterocyclic Compounds in ZSM-5 Zeolite: A Combination of Perturbation Theory (MP2) and a Newly Developed Density Functional Theory (M06-2X) in ONIOM Scheme
Boekfa, Bundet, Choomwattana, Saowapak, Khongpracha, Pipat, Limtrakul, Jumras
Published in Langmuir (17.11.2009)
Published in Langmuir (17.11.2009)
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Journal Article
Structure, Interaction, and Dynamics of Au/Pd Bimetallic Nanoalloys Dispersed in Aqueous Ethylpyrrolidone, a Monomeric Moiety of Polyvinylpyrrolidone
Gupta, Aditi, Boekfa, Bundet, Sakurai, Hidehiro, Ehara, Masahiro, Priyakumar, U. Deva
Published in Journal of physical chemistry. C (11.08.2016)
Published in Journal of physical chemistry. C (11.08.2016)
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Journal Article
C–Cl Bond Activation on Au/Pd Bimetallic Nanocatalysts Studied by Density Functional Theory and Genetic Algorithm Calculations
Boekfa, Bundet, Pahl, Elke, Gaston, Nicola, Sakurai, Hidehiro, Limtrakul, Jumras, Ehara, Masahiro
Published in Journal of physical chemistry. C (25.09.2014)
Published in Journal of physical chemistry. C (25.09.2014)
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Journal Article
Metal–Porphyrin: A Potential Catalyst for Direct Decomposition of N2O by Theoretical Reaction Mechanism Investigation
Maitarad, Phornphimon, Namuangruk, Supawadee, Zhang, Dengsong, Shi, Liyi, Li, Hongrui, Huang, Lei, Boekfa, Bundet, Ehara, Masahiro
Published in Environmental science & technology (17.06.2014)
Published in Environmental science & technology (17.06.2014)
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Journal Article
Adsorption and dehydration of ethanol on isomorphously B, Al, and Ga substituted H-ZSM-5 zeolite: an embedded ONIOM study
Maeboonruan, Nattida, Boekfa, Bundet, Maihom, Thana, Treesukol, Piti, Kongpatpanich, Kanokwan, Namuangruk, Supawadee, Probst, Michael, Limtrakul, Jumras
Published in Journal of molecular modeling (01.12.2021)
Published in Journal of molecular modeling (01.12.2021)
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N2O decomposition over Fe-zeolites: Structure of the active sites and the origin of the distinct reactivity of Fe-ferrierite, Fe-ZSM-5, and Fe-beta. A combined periodic DFT and multispectral study
SKLENAK, Stepan, ANDRIKOPOULOS, Prokopis C, BOEKFA, Bundet, JANSANG, Bavornpon, NOVAKOVA, Jana, BENCO, Lubomir, BUCKO, Tomas, HAFNER, Juergen, DEDECEK, Jiří, SOBALIK, Zdeněk
Published in Journal of catalysis (15.06.2010)
Published in Journal of catalysis (15.06.2010)
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Combined Experimental and Theoretical Study of the Synthesis of 5,7-Dihydroxy-4-methylcoumarin via a Pechmann Condensation in the Presence of UiO-66-SO3H Catalysts
Srirattanasakunsuk, Pattraporn, Boekfa, Bundet, Treesukol, Piti, Jarussophon, Nongpanga, Maihom, Thana, Kongpatpanich, Kanokwan, Limtrakul, Jumras
Published in ACS omega (12.12.2023)
Published in ACS omega (12.12.2023)
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Turn-on fluorescent sensor for the detection of lipopolysaccharides based on a novel bispyrenyl terephtalaldehyde-bis-guanylhydrazone
Khownium, Kriangsak, Romsaiyud, Jariya, Borwornpinyo, Suparerk, Wongkrasant, Preedajit, Pongkorpsakol, Pawin, Muanprasat, Chatchai, Boekfa, Bundet, Vilaivan, Tirayut, Ruchirawat, Somsak, Limtrakul, Jumras
Published in New journal of chemistry (2019)
Published in New journal of chemistry (2019)
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Journal Article
Exploitation of missing linker in Zr-based metal-organic framework as the catalyst support for selective oxidation of benzyl alcohol
Jumpathong, Watthanachai, Pila, Taweesak, Lekjing, Yuwanda, Chirawatkul, Prae, Boekfa, Bundet, Horike, Satoshi, Kongpatpanich, Kanokwan
Published in APL materials (01.11.2019)
Published in APL materials (01.11.2019)
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Journal Article
Theoretical and experimental investigation of NMR, IR and UV-Visible spectra of hydroxyl-substituted 4-chloromethylcoumarin derivatives
Loarueng, Chutipapha, Boekfa, Bundet, Jarussophon, Suwatchai, Pongwan, Pawinee, Kaewchangwat, Narongpol, Suttisintong, Khomson, Jarussophon, Nongpanga
Published in ARKIVOC free online journal of organic chemistry (01.01.2019)
Published in ARKIVOC free online journal of organic chemistry (01.01.2019)
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Journal Article
A Simple “Nano-Templating” Method Using Zeolite Y Toward the Formation of Carbon Schwarzites
Boonyoung, Pawan, Kasukabe, Takatoshi, Hoshikawa, Yasuto, Berenguer-Murcia, Ángel, Cazorla-Amorós, Diego, Boekfa, Bundet, Nishihara, Hirotomo, Kyotani, Takashi, Nueangnoraj, Khanin
Published in Frontiers in materials (16.05.2019)
Published in Frontiers in materials (16.05.2019)
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First-Principle study of lithium polysulfide adsorption on heteroatom doped graphitic carbon nitride for Lithium-Sulfur batteries
Yamsang, Nattida, Sittiwong, Jarinya, Srifa, Pemikar, Boekfa, Bundet, Sawangphruk, Montree, Maihom, Thana, Limtrakul, Jumras
Published in Applied surface science (01.11.2021)
Published in Applied surface science (01.11.2021)
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Journal Article
Incorporation of Al3+ Sites on Brønsted Acid Metal–Organic Frameworks for Glucose‐to‐Hydroxylmethylfurfural Transformation
Tangsermvit, Vitsarut, Pila, Taweesak, Boekfa, Bundet, Somjit, Vetiga, Klysubun, Wantana, Limtrakul, Jumras, Horike, Satoshi, Kongpatpanich, Kanokwan
Published in Small (Weinheim an der Bergstrasse, Germany) (01.06.2021)
Published in Small (Weinheim an der Bergstrasse, Germany) (01.06.2021)
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