화학공학소재연구정보센터
검색결과 : 27건
No. Article
1 Ethene hydrogenation on zeolite-supported rhodium clusters. A mechanistic study by density functional and microkinetic modeling
Markova VK, Vayssilov GN, Genest A, Rosch N
Applied Catalysis A: General, 543, 201, 2017
2 One-pot synthesis of silanol-free nanosized MFI zeolite
Grand J, Talapaneni SN, Vicente A, Fernandez C, Dib E, Aleksandrov HA, Vayssilov GN, Retoux R, Boullay P, Gilson JP, Valtchev V, Mintova S
Nature Materials, 16(10), 1010, 2017
3 FTIR and density functional study of NO interaction with reduced ceria: Identification of N-3(-) and NO2- as new intermediates in NO conversion
Mihaylov MY, Ivanova EZ, Aleksandrov HA, St Petkov P, Vayssilov GN, Hadjiivanov KI
Applied Catalysis B: Environmental, 176, 107, 2015
4 Theoretical and Experimental Local Reactivity Parameters of 3-Substituted Coumarin Derivatives
Petkova NI, Nikolova RD, Rostov KL, Mineva T, Vayssilov GN
Journal of Physical Chemistry A, 118(46), 11062, 2014
5 Enhanced reactivity of carbonyl compounds on MgO surface: A computational study
Petrova GP, Vayssilov GN, Galabov B
Journal of Molecular Catalysis A-Chemical, 342-43, 67, 2011
6 Density Functional Study of Hydrogen Bond Formation between Methanol and Organic Molecules Containing Cl, F, NH2, OH, and COOH Functional Groups
Kolev SK, St Petkov P, Rangelov MA, Vayssilov GN
Journal of Physical Chemistry A, 115(48), 14054, 2011
7 Support nanostructure boosts oxygen transfer to catalytically active platinum nanoparticles
Vayssilov GN, Lykhach Y, Migani A, Staudt T, Petrova GP, Tsud N, Skala T, Bruix A, Illas F, Prince KC, Matolin V, Neyman KM, Libuda J
Nature Materials, 10(4), 310, 2011
8 Theoretical investigation of ethane dehydrogenation on cationic Zn species in ZSM-5 zeolites-The second Al center in vicinity of the cation is essential for the accomplishment of the complete catalytic cycle
Aleksandrov HA, Vayssilov GN
Catalysis Today, 152(1-4), 78, 2010
9 CO coordination at XNi4 clusters with impurities X = H, C, O. A density functional study
Petkov PS, Vayssilov GN, Kruger S, Rosch N
Journal of Physical Chemistry A, 112(37), 8523, 2008
10 Density functional modeling of reverse hydrogen spillover on zeolite-supported tetrairidium clusters
Petrova GP, Vayssilov GN, Rosch N
Chemical Physics Letters, 444(4-6), 215, 2007