| # | Document title | Authors | Year | Source | Cited by |
| 1 | Reaction mechanisms of the methylation of ethene with methanol and dimethyl ether over h-zsm-5: An ONIOM study | Maihom T., Maihom T., Boekfa B., Boekfa B., Sirijaraensre J., Sirijaraensre J., Nanok T., Nanok T., Probst M., Limtrakul J., Limtrakul J. | 2009 | Journal of Physical Chemistry C
113(16),pp. 6654-6662 | 143 |
| 2 | 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 S., Andrikopoulos P., Boekfa B., Jansang B., Nováková J., Benco L., Bucko T., Hafner J., Ddeek J., Sobalík Z. | 2010 | Journal of Catalysis
272(2),pp. 262-274 | 121 |
| 3 | Production of formic acid via hydrogenation of CO2 over a copper-alkoxide-functionalized MOF: A mechanistic study | Maihom T., Wannakao S., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2013 | Journal of Physical Chemistry C
117(34),pp. 17650-17658 | 97 |
| 4 | 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 B., Boekfa B., Choomwattana S., Choomwattana S., Khongpracha P., Khongpracha P., Limtrakul J., Limtrakul J. | 2009 | Langmuir
25(22),pp. 12990-12999 | 77 |
| 5 | Adsorption and tautomerization reaction of acetone on acidic zeolites: The confinement effect in different types of zeolites | Boekfa B., Pantu P., Probst M., Limtrakul J. | 2010 | Journal of Physical Chemistry C
114(35),pp. 15061-15067 | 65 |
| 6 | Structures and reaction mechanisms of glycerol dehydration over H-ZSM-5 zeolite: A density functional theory study | Kongpatpanich K., Kongpatpanich K., Nanok T., Nanok T., Boekfa B., Probst M., Limtrakul J., Limtrakul J. | 2011 | Physical Chemistry Chemical Physics
13(14),pp. 6462-6470 | 56 |
| 7 | Skeletal isomerization of 1-butene over ferrierite zeolite: A quantum chemical analysis of structures and reaction mechanisms | Wattanakit C., Nokbin S., Boekfa B., Boekfa B., Pantu P., Limtrakul J. | 2012 | Journal of Physical Chemistry C
116(9),pp. 5654-5663 | 43 |
| 8 | Metal-porphyrin: A potential catalyst for direct decomposition of N 2O by theoretical reaction mechanism investigation | Maitarad P., Namuangruk S., Zhang D., Shi L., Li H., Huang L., Boekfa B., Ehara M. | 2014 | Environmental Science and Technology
48(12),pp. 7101-7110 | 43 |
| 9 | C-Cl bond activation on Au/Pd bimetallic nanocatalysts studied by density functional theory and genetic algorithm calculations | Boekfa B., Boekfa B., Boekfa B., Pahl E., Gaston N., Sakurai H., Limtrakul J., Ehara M., Ehara M. | 2014 | Journal of Physical Chemistry C
118(38),pp. 22188-22196 | 39 |
| 10 | Oxidative Dehydrogenation of Propane over a VO2-Exchanged MCM-22 Zeolite: A DFT Study | Wannakao S., Boekfa B., Khongpracha P., Probst M., Limtrakul J. | 2010 | ChemPhysChem
11(16),pp. 3432-3438 | 36 |
| 11 | The adsorption of saturated and unsaturated hydrocarbons on nanostructured zeolites (H-MOR and H-FAU): An ONIOM study | Pantu P., Pantu P., Boekfa B., Limtrakul J., Limtrakul J. | 2007 | Journal of Molecular Catalysis A: Chemical
277(1-2),pp. 171-179 | 36 |
| 12 | Density functional study of the activity of gold-supported ZSM-5 zeolites for nitrous oxide decomposition | Maihom T., Wannakao S., Boekfa B., Limtrakul J. | 2013 | Chemical Physics Letters
556,pp. 217-224 | 29 |
| 13 | Aluminum siting in the ZSM-22 and theta-1 zeolites revisited: A QM/MM study | Sklenak S., Dědecěk J., Li C., Gao F., Jansang B., Boekfa B., Wichterlova B., Sauer J. | 2008 | Collection of Czechoslovak Chemical Communications
73(6-7),pp. 909-920 | 26 |
| 14 | Theoretical study on 31P NMR chemical shifts of phosphorus-modified CHA zeolites | Zhao P., Boekfa B., Nishitoba T., Tsunoji N., Sano T., Yokoi T., Ogura M., Ehara M., Ehara M. | 2020 | Microporous and Mesoporous Materials
294 | 26 |
| 15 | Structure, Interaction, and Dynamics of Au/Pd Bimetallic Nanoalloys Dispersed in Aqueous Ethylpyrrolidone, a Monomeric Moiety of Polyvinylpyrrolidone | Gupta A., Boekfa B., Sakurai H., Ehara M., Priyakumar U.D. | 2016 | Journal of Physical Chemistry C
120(31),pp. 17454-17464 | 25 |
| 16 | Interactions of amino acids with H-ZSM-5 zeolite: An embedded ONIOM study | Boekfa B., Pantu P., Pantu P., Limtrakul J., Limtrakul J. | 2008 | Journal of Molecular Structure
889(1-3),pp. 81-88 | 25 |
| 17 | Incorporation of Al3+ Sites on Brønsted Acid Metal–Organic Frameworks for Glucose-to-Hydroxylmethylfurfural Transformation | Tangsermvit V., Pila T., Boekfa B., Somjit V., Klysubun W., Limtrakul J., Horike S., Horike S., Kongpatpanich K. | 2021 | Small
| 23 |
| 18 | First-Principle study of lithium polysulfide adsorption on heteroatom doped graphitic carbon nitride for Lithium-Sulfur batteries | Yamsang N., Sittiwong J., Srifa P., Boekfa B., Sawangphruk M., Maihom T., Maihom T., Limtrakul J. | 2021 | Applied Surface Science
565 | 23 |
| 19 | Theoretical study on the reaction mechanism of hydrogenation of furfural to furfuryl alcohol on Lewis acidic BEA zeolites: Effects of defect structure and tetravalent metals substitution | Injongkol Y., Injongkol Y., Maihom T., Maihom T., Treesukul P., Sirijaraensre J., Boekfa B., Boekfa B., Limtrakul J. | 2017 | Physical Chemistry Chemical Physics
19(35),pp. 24042-24048 | 22 |
| 20 | Nanocavity effects on N2O decomposition on different types of Fe-Zeolites (Fe-FER, Fe-BEA, Fe-ZSM-5 and Fe-FAU): A combined theoretical and experimental study | Pantu P., Boekfa B., Sunpetch B., Limtrakul J. | 2008 | Chemical Engineering Communications
195(11),pp. 1477-1485 | 19 |
| 21 | Construction of 5-Aminotetrazoles via in Situ Generation of Carbodiimidium Ions from Ketones Promoted by TMSN3/TfOH | Nimnual P., Tummatorn J., Tummatorn J., Boekfa B., Thongsornkleeb C., Thongsornkleeb C., Ruchirawat S., Ruchirawat S., Piyachat P., Punjajom K. | 2019 | Journal of Organic Chemistry
84(9),pp. 5603-5613 | 19 |
| 22 | Mechanism of Ullmann Coupling Reaction of Chloroarene on Au/Pd Alloy Nanocluster: A DFT Study | Meeprasert J., Namuangruk S., Boekfa B., Boekfa B., Dhital R.N., Sakurai H., Ehara M., Ehara M. | 2016 | Organometallics
35(9),pp. 1192-1201 | 15 |
| 23 | Theoretical study of CO2 hydrogenation into formic acid on Lewis acid zeolites | Thongnuam W., Maihom T., Choomwattana S., Injongkol Y., Boekfa B., Treesukol P., Limtrakul J. | 2018 | Physical Chemistry Chemical Physics
20(39),pp. 25179-25185 | 15 |
| 24 | A simple “nano-templating” method using zeolite y toward the formation of carbon schwarzites | Boonyoung P., Kasukabe T., Hoshikawa Y., Berenguer-Murcia Á., Cazorla-Amorós D., Boekfa B., Nishihara H., Kyotani T., Nueangnoraj K. | 2019 | Frontiers in Materials
6 | 14 |
| 25 | Exploitation of missing linker in Zr-based metal-organic framework as the catalyst support for selective oxidation of benzyl alcohol | Jumpathong W., Jumpathong W., Pila T., Lekjing Y., Chirawatkul P., Boekfa B., Horike S., Horike S., Horike S., Kongpatpanich K. | 2019 | APL Materials
7(11) | 14 |
| 26 | Selective catalytic reduction of NO with NH3over Cu-exchanged CHA, GME, and AFX zeolites: a density functional theory study | Zhao P., Zhao P., Boekfa B., Shimizu K.I., Shimizu K.I., Ogura M., Ogura M., Ehara M., Ehara M. | 2021 | Catalysis Science and Technology
11(5),pp. 1780-1790 | 13 |
| 27 | The coumarin synthesis: a combined experimental and theoretical study | Pornsatitworakul S., Pornsatitworakul S., Boekfa B., Boekfa B., Maihom T., Maihom T., Treesukol P., Treesukol P., Namuangruk S., Jarussophon S., Jarussophon N., Limtrakul J. | 2017 | Monatshefte fur Chemie
148(7),pp. 1245-1250 | 13 |
| 28 | Density functional theory study on catalytic cracking of n-hexane on heteropoly acid: A comparison with acidic zeolite | Choomwattana S., Maihom T., Boekfa B., Boekfa B., Pantu P., Limtrakul J. | 2012 | Canadian Journal of Chemical Engineering
90(4),pp. 865-872 | 12 |
| 29 | The activation of methane on Ru, Rh, and Pd decorated carbon nanotube and boron nitride nanotube: A DFT study | Boekfa B., Boekfa B., Treesukol P., Treesukol P., Injongkol Y., Injongkol Y., Maihom T., Maihom T., Maitarad P., Limtrakul J. | 2018 | Catalysts
8(5) | 12 |
| 30 | Glycine peptide bond formation catalyzed by faujasite | Phuakkong O., Bobuatong K., Pantu P., Boekfa B., Boekfa B., Probst M., Limtrakul J. | 2011 | ChemPhysChem
12(11),pp. 2160-2168 | 12 |
| 31 | Catalytic oxidation of CO with N2O on Fe-porphyrin catalyst | Pornsatitworakul S., Pornsatitworakul S., Phikulthai S., Phikulthai S., Namuangruk S., Boekfa B., Boekfa B. | 2015 | Proceedings 2015 International Conference on Science and Technology, TICST 2015
,pp. 225-229 | 10 |
| 32 | Hydroxylation of UiO-66 Metal-Organic Frameworks for High Arsenic(III) Removal Efficiency | Somjit V., Thinsoongnoen P., Pila T., Boekfa B., Wannapaiboon S., Kongpatpanich K. | 2022 | Inorganic Chemistry
| 9 |
| 33 | Theoretical study of methane adsorption and C─H bond activation over Fe-embedded graphene: Effect of external electric field | Ketrat S., Maihom T., Maihom T., Treesukul P., Boekfa B., Limtrakul J. | 2019 | Journal of Computational Chemistry
40(32),pp. 2819-2826 | 9 |
| 34 | Turn-on fluorescent sensor for the detection of lipopolysaccharides based on a novel bispyrenyl terephtalaldehyde-bis-guanylhydrazone | Khownium K., Romsaiyud J., Borwornpinyo S., Wongkrasant P., Pongkorpsakol P., Muanprasat C., Boekfa B., Vilaivan T., Ruchirawat S., Limtrakul J. | 2019 | New Journal of Chemistry
43(18),pp. 7051-7056 | 8 |
| 35 | Computational study of the conversion of methane and carbon dioxide to acetic acid over NU-1000 metal–organic framework-supported single-atom metal catalysts | Sittiwong J., Opasmongkolchai O., Srifa P., Boekfa B., Treesukol P., Sangthong W., Maihom T., Maihom T., Limtrakul J. | 2023 | Molecular Catalysis
535 | 7 |
| 36 | Intrinsic Hole Mobility in Luminescent Metal–Organic Frameworks and Its Application in Organic Light-Emitting Diodes | Kaiyasuan C., Somjit V., Boekfa B., Packwood D., Chasing P., Sudyoadsuk T., Kongpatpanich K., Promarak V. | 2022 | Angewandte Chemie - International Edition
| 7 |
| 37 | Theoretical and Experimental Study on the 7-Hydroxy-4-Methylcoumarin Synthesis with H-Beta Zeolite | Klinyod S., Boekfa B., Pornsatitworakul S., Maihom T., Jarussophon N., Treesukol P., Wattanakit C., Limtrakul J. | 2019 | ChemistrySelect
4(36),pp. 10660-10667 | 6 |
| 38 | A mechanistic study of ethanol transformation into ethene and acetaldehyde on an oxygenated Au-exchanged ZSM-5 zeolite | Injongkol Y., Injongkol Y., Maihom T., Maihom T., Choomwattana S., Boekfa B., Boekfa B., Limtrakul J. | 2017 | RSC Advances
7(60),pp. 38052-38058 | 6 |
| 39 | Density functional study of the effect of cation exchanged Sn-Beta zeolite for the diels-alder reaction between furan and methyl acrylate | Paluka V., Maihom T., Maihom T., Warakulwit C., Srifa P., Boekfa B., Treesukol P., Poolmee P., Limtrakul J. | 2020 | Chemical Physics Letters
754 | 5 |
| 40 | A quantum chemical study of the interaction of carbonyls with H-ZSM-5 zeolite | Boekfa B., Sirijareansre J., Pantu P., Limtrakul J. | 2004 | Studies in Surface Science and Catalysis
154 B,pp. 1582-1588 | 5 |
| 41 | Adsorption and dehydration of ethanol on isomorphously B, Al, and Ga substituted H-ZSM-5 zeolite: an embedded ONIOM study | Maeboonruan N., Boekfa B., Boekfa B., Maihom T., Treesukol P., Kongpatpanich K., Namuangruk S., Probst M., Probst M., Limtrakul J. | 2021 | Journal of Molecular Modeling
27(12) | 5 |
| 42 | Aluminum‐based metal‐organic framework support metal(II)-hydride as catalyst for the hydrogenation of carbon dioxide to formic acid: A computational study | Nilwanna K., Sittiwong J., Boekfa B., Treesukol P., Boonya-udtayan S., Probst M., Probst M., Maihom T., Maihom T., Limtrakul J. | 2023 | Molecular Catalysis
541 | 3 |
| 43 | Density Functional and Coupled Cluster Study on the Conversion of Ethanol to Acetaldehyde on Isolated Zinc Sites Supported on Dealuminated BEA Zeolite | Jeevapong W., Sittiwong J., Probst M., Probst M., Boekfa B., Wattanakit C., Maihom T., Maihom T., Limtrakul J. | 2023 | Journal of Physical Chemistry C
| 3 |
| 44 | Diastereoselective Synthesis of Spirocyclic Ether from ortho-Carbonylarylacetylenols via Silver-Catalyzed Cyclization under Acidic Conditions | Jaithum K., Tummatorn J., Tummatorn J., Boekfa B., Thongsornkleeb C., Thongsornkleeb C., Chainok K., Ruchirawat S., Ruchirawat S. | 2021 | Advanced Synthesis and Catalysis
| 3 |
| 45 | An experimental and theoretical study on the aldol condensation on zirconium-based metal-organic framework | Thongnuam W., Thongnuam W., Pornsatitworakul S., Pornsatitworakul S., Maihom T., Maihom T., Treesukol P., Treesukol P., Jarussophon N., Maitarad P., Kongpatpanich K., Boekfa B. | 2017 | Key Engineering Materials
757 KEM,pp. 98-102 | 3 |
| 46 | Theoretical and experimental investigation of NMR, IR and UV-visible spectra of hydroxyl-substituted-4-chloromethylcoumarin derivatives | Loarueng C., Boekfa B., Jarussophon S., Pongwan P., Kaewchangwat N., Suttisintong K., Jarussophon N. | 2019 | Arkivoc
2019(6) | 2 |
| 47 | Adsorption of glycine amino acid in zeolite: An embedded QM/MM study | Boekfa B., Sirijaraensre J., Limtrakul P., Pantu P., Limtrakul J. | 2007 | 2007 NSTI Nanotechnology Conference and Trade Show - NSTI Nanotech 2007, Technical Proceedings
1,pp. 454-457 | 1 |
| 48 | Theoretical mechanistic study of the ethylene oxidation over permanganate: effect of BF3 Lewis acid | Maihom T., Maihom T., Choomwattana S., Boekfa B., Boekfa B., Treesukol P. | 2017 | Monatshefte fur Chemie
148(7),pp. 1277-1284 | 1 |
| 49 | The quantum confinement effect on the adsorption and reaction of aliphatic hydrocarbons on 'Nano Reactor' ZSM-5 zeolite: A newly developed Density Functional Theory (DFT) investigation | Boekfa B., Choomwattana S., Maitarad P., Limtrakul P., Limtrakul J. | 2009 | Technical Proceedings of the 2009 NSTI Nanotechnology Conference and Expo, NSTI-Nanotech 2009
3,pp. 268-271 | 1 |
| 50 | N2O decomposition on iron exchanged ferrierite. A combined periodic DFT and static IN-SITU FTIR study | Sklenak S., Sobalík Z., Tvarůžková Z., Jansang B., Li C., Gao F., Boekfa B., Benco L., Bucko T., Hafner J. | 2008 | Studies in Surface Science and Catalysis
174(SUPPL. PART A),pp. 713-716 | 0 |
| 51 | Structures and reaction mechanisms of n-butanol conversion to iso-butene over theta-1 zeolite: A DFT study | Wiangngean J., Wiangngean J., Kongpatpanich K., Kongpatpanich K., Wannakao S., Wannakao S., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 52 | Skeletal isomerization of 1-butene to isobutene on H-ZSM-5 zeolite: A newly developed density functional theory study | Boekfa B., Boekfa B., Kongpatpanich K., Kongpatpanich K., Limtrakul P., Limtrakul P., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 53 | Quantum effect on the reaction mechanism of propene oxide isomerization in H-ITQ-22: A DFT investigation | Theanngern K., Theanngern K., Boekfa B., Boekfa B., Khongpracha P., Khongpracha P., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 54 | Structures and reaction mechanisms of butadiene cycloaddition over metal-exchanged faujasite | Yutthalekha T., Yutthalekha T., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 55 | Reaction mechanism of isomerization of 1-butene to isobutene over multipore H-ITQ-22 zeolite: A DFT study | Boekfa B., Boekfa B., Treesukol P., Treesukol P., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 56 | Reaction mechanisms of ethene formation via ethanol dehydration catalyzed by Fe-ZSM-5 zeolite: An ONIOM study with an M06-L functional | Maihom T., Boekfa B., Wannakao S., Limtrakul J. | 2010 | ACS National Meeting Book of Abstracts
| 0 |
| 57 | Quantum chemical calculation of the hydrogenation reaction of encapsulated formaldehyde in Na-FAU zeolite | Sangthong W., Sangthong W., Wannakao S., Wannakao S., Choomwattana S., Choomwattana S., Maihom T., Maihom T., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2010 | ACS National Meeting Book of Abstracts
| 0 |
| 58 | Catalytic dehydrogenation of ethylbenzene to styrene over Fe-ZSM-5 zeolite: A newly developed density functional theory (M06-L) in ONIOM scheme | Boekfa B., Boekfa B., Maihom T., Maihom T., Wannakao S., Wannakao S., Limtrakul P., Limtrakul P., Limtrakul J., Limtrakul J. | 2010 | ACS National Meeting Book of Abstracts
| 0 |
| 59 | Structures and reaction mechanisms of butadiene cycloaddition over metal-exchanged faujasite | Yutthalekha T., Yutthalekha T., Kongpatpanich K., Kongpatpanich K., Maihom T., Maihom T., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 60 | Oxidation of carbon monoxide by nitrous oxide decomposition on Fe-embedded graphene | Wannakao S., Wannakao S., Maihom T., Maihom T., Khongpracha P., Khongpracha P., Boekfa B., Boekfa B., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 61 | Shape-selective hydrocarbon cracking of n-hexane on MCM-22 zeolite: Pore shape stability on zeolites | Tiewcharoen S., Tiewcharoen S., Boekfa B., Boekfa B., Treesukol P., Treesukol P., Maihom T., Maihom T., Limtrakul J., Limtrakul J. | 2011 | ACS National Meeting Book of Abstracts
| 0 |
| 62 | Combined computational and experimental studies of trans- and cis-isomers of potassium diaquabis(oxalato)chromate (III) | Ruangchaithaweesuk S., Chorkate J., Maihom T., Maihom T., Poolmee P., Poolmee P., Treesukol P., Treesukol P., Rungsawang T., Maitarad P., Boekfa B. | 2017 | Key Engineering Materials
757 KEM,pp. 103-107 | 0 |
| 63 | Adsorption of ammonia on zirconium-based metal-organic framework: A combined experimental and theoretical study | Phikulthai S., Phikulthai S., Injongkol Y., Injongkol Y., Maihom T., Maihom T., Treesukol P., Treesukol P., Maitarad P., Tangsermvit V., Kongpatpanich K., Boekfa B., Boekfa B. | 2017 | Key Engineering Materials
757 KEM,pp. 93-97 | 0 |
| 64 | Biodegradation of Levan Polymer / Poly (Lactic Acid) (PLA) Blend | Phengnoi P., Thongmee K., Tiptipakorn S., Boekfa B., Kuttiyawong K. | 2019 | IOP Conference Series: Materials Science and Engineering
526(1) | 0 |
| 65 | Methane dissociative reaction on Rh-decorated carbon and boron-nitride nanotubes | Injongkol Y., Injongkol Y., Boekfa B., Boekfa B., Treesukol P., Treesukol P. | 2015 | Proceedings 2015 International Conference on Science and Technology, TICST 2015
,pp. 218-224 | 0 |
| 66 | 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 P., Srirattanasakunsuk P., Boekfa B., Boekfa B., Treesukol P., Jarussophon N., Maihom T., Kongpatpanich K., Limtrakul J. | 2023 | ACS Omega
| 0 |
| 67 | Theoretical insights into poly(ethylene terephthalate) glycolysis catalyzed by acid-base pairs in Zn-supported MOF-808 metal-organic framework | Nilwanna K., Sittiwong J., Srifa P., Boekfa B., Treesukol P., Probst M., Probst M., Maihom T., Maihom T., Limtrakul J. | 2024 | Chemical Physics Letters
836 | 0 |
| 68 | Investigation of the Suzuki–Miyaura cross-coupling reaction on a palladium H-beta zeolite with DFT calculations | Boekfa B., Boekfa B., Maihom T., Maihom T., Ehara M., Limtrakul J. | 2024 | Scientific Reports
14(1) | 0 |