| Глава от книга |
|
|
Georgi N. Vayssilov, Hristiyan A. Aleksandrov, Galina P. Petrova, Petko St. Petkov, Computational Modelling of Nanoporous Materials, ISBN:978-0-444-53189-6, Elsevier, Amsterdam, Ref, Рецензирано
|
2009
|
| Друго (научно-популярни и др. под.) |
|
1
|
G. N. Vayssilov, Third Humboldt Conference on Computational Chemistry - Preface,
|
2007
|
|
2
|
G. N. Vayssilov, Special issue: Proceedings from the Second Humboldt Conference on Computational Chemistry - Preface,
|
2006
|
| Статия в научно списание |
|
1
|
Oh, Dong Gun, Aleksandrov, Hristiyan A, Kim, Haneul, Koleva, Iskra Z, Khivantsev, Konstantin, Vayssilov, Georgi N, Kwak, Ja Hun, 4 Oxidation., Molecules (Basel, Switzerland), vol:28, issue:4, 2023, ISSN (online):1420-3049, doi:10.3390/molecules28041957
|
2023
|
|
2
|
Eddy Dib, Svetlana Mintova, Georgi N. Vayssilov, Hristiyan A. Aleksandrov, Marina Carravetta, Chemical Shift Anisotropy: A Promising Parameter To Distinguish the 29Si NMR Peaks in Zeolites, The Journal of Physical Chemistry C, vol:127, issue:22, 2023, pages:10792-10796, Ref, Web of Science, International
|
2023
|
|
3
|
Peng Peng, Simona Moldovan, Aurélie Vicente, Valérie Ruaux, Maxime Debost, Han Hu, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Zi-Feng Yan, Svetlana Mintova, Synthesis of nanosized MFI zeolites using Cu-containing complexes, Microporous and Mesoporous Materials, vol:357, 2023, pages:112625-0, doi:10.1016/j.micromeso.2023.112625, Ref, Web of Science, International
|
2023
|
|
4
|
Oh, Dong Gun, Aleksandrov, Hristiyan A., Kim, Haneul, Koleva, Iskra Z., Khivantsev, Konstantin, Vayssilov, Georgi N., Kwak, Ja Hun, Understanding of Active Sites and Interconversion of Pd and PdO during CH4 Oxidation, MOLECULES, vol:28, issue:4, 2023, ISSN (online):1420-3049, doi:10.3390/molecules28041957
|
2023
|
|
5
|
Edwin Clatworthy, Simona Moldovan, Kalthoum Nakouri, Stoyan P. Gramatikov, Francesco Dalena, Marco Daturi, Petko Petkov, Georgi Vayssilov, Svetlana Mintova, Visualizing the Flexibility of RHO Nanozeolite: Experiment and Modeling, Journal of the American Chemical Society, 2023
|
2023
|
|
6
|
Qin, Zhengxing, You, Zhenchao, Bozhilov, Krassimir N., Kolev, Stefan K., Yang, Wei, Shen, Yanfeng, Gilson, Jean-Pierre, Mintova, Svetlana, Georgi Vayssilov, Valtchev, Valentin, Dissolution Behavior and Varied Mesoporosity of Zeolites by NH4F Etching
, CHEMISTRY-A EUROPEAN JOURNAL, vol:28, 2022, pages:202104339-0, doi:10.1002/chem.202104339, Ref, IF (5.02 - 2022), Web of Science Quartile: Q1 (2022), SCOPUS, SJR ( - 2022), International
|
2022
|
|
7
|
Dong Gun Oh, Hristiyan A. Aleksandrov, Haneul Kim, Iskra Z. Koleva, Konstantin Khivantsev, Georgi N. Vayssilov, Ja Hun Kwak, Key Role of a-Top CO on Terrace Sites of Metallic Pd Clusters for CO Oxidation, Chemistry A European Journal, vol:28, issue:49, 2022, doi:https://doi.org/10.1002/chem.202200684, Ref, Web of Science, International
|
2022
|
|
8
|
Nuber, Matthias, Spanier, Lukas V, Roth, Sebastian, Vayssilov, Georgi N, Kienberger, Reinhard, Muller-Buschbaum, Peter, Iglev, Hristo, Picosecond Charge-Transfer-State Dynamics in Wide Band Gap Polymer-Non-Fullerene Small-Molecule Blend Films Investigated via Transient Infrared Spectroscopy., The journal of physical chemistry letters, vol:13, issue:44, 2022, pages:10418-10423, ISSN (online):1948-7185, doi:10.1021/acs.jpclett.2c02864
|
2022
|
|
9
|
Vayssilov, Georgi N., Aleksandrov, Hristiyan A., Dib, Eddy, Costa, Izabel Medeiros, Nesterenko, Nikolai, Mintova, Svetlana, Superacidity and spectral signatures of hydroxyl groups in zeolites, MICROPOROUS AND MESOPOROUS MATERIALS, vol:343, 2022, ISSN (print):1387-1811, ISSN (online):1873-3093, doi:10.1016/j.micromeso.2022.112144
|
2022
|
|
10
|
Stoyan P. Gramatikov, Petko St. Petkov, Georgi N. Vayssilov, The relative stability of SCM-14 germanosilicate with different distributions of germanium ions in the absence and presence of structure-directing agents, Inorganic Chemistry Frontiers, 2022
|
2022
|
|
11
|
Izabel C. Medeiros-Cost, Eddy Dib, Florent Dubray, Simona Moldovan, Jean-Pierre Gilson, Jean-Pierre Dath, Nikolai Nesterenko, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Svetlana Mintova, Unraveling the Effect of Silanol Defects on the Insertion of Single-Site Mo in the MFI Zeolite Framework, Inorganic Chemistry, vol:61, issue:3, 2022, pages:1418-1425, Ref, Web of Science, International
|
2022
|
|
12
|
Konstantin Khivantsev, Nicholas R. Jaegers, Hristiyan A. Aleksandrov, Libor Kovarik, Miroslaw A. Derewinski, Yong Wang, Georgi N. Vayssilov, Janos Szanyi, Biomimetic CO oxidation below −100 °C by a nitrate-containing metal-free microporous system, Nature Communications, vol:12, 2021, pages:6033-0, ISSN (online):2041-1723, Ref, Web of Science, International
|
2021
|
|
13
|
Khivantsev, Konstantin, Jaegers, Nicholas R, Aleksandrov, Hristiyan A, Kovarik, Libor, Derewinski, Miroslaw A, Wang, Yong, Vayssilov, Georgi N, Biomimetic CO oxidation below -100°C by a nitrate-containing metal-free microporous system., Nature communications, vol:12, issue:1, 2021, ISSN (online):2041-1723, doi:10.1038/s41467-021-26157-3
|
2021
|
|
14
|
Khivantsev, Konstantin, Jaegers, Nicholas R., Aleksandrov, Hristiyan A., Kovarik, Libor, Derewinski, Miroslaw A., Wang, Yong, Vayssilov, Georgi N., Szanyi, Janos, Biomimetic CO oxidation below-100 degrees C by a nitrate-containing metal-free microporous system, NATURE COMMUNICATIONS, vol:12, issue:1, 2021, ISSN (online):2041-1723, doi:10.1038/s41467-021-26157-3
|
2021
|
|
15
|
Konstantin Khivantsev, Artem Vityuk, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Oleg S. Alexeev, Michael D. Amiridis, Catalytic conversion of ethene to butadiene or hydrogenation to ethane on HY zeolite supported rhodium complexes: Cooperative support/Rh-center route, The Journal of Chemical Physics, vol:154, 2021, pages:184706-0, doi:https://doi.org/10.1063/5.0042322, Ref, Web of Science, International
|
2021
|
|
16
|
Eddy Dib, Izabel Medeiros Costa, Georgi N. Vayssilov, Hristiyan A. Aleksandrov, Svetlana Mintova, Complex H-bonded silanol network in zeolites revealed by IR and NMR spectroscopy combined with DFT calculations, Journal of Materials Chemistry A, vol:9, 2021, pages:27347-27352, doi:10.1039/D1TA06908J, Ref, Web of Science, International
|
2021
|
|
17
|
Petko St. Petkov, Kristina Simeonova, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Yoshihiro Kubota, Satoshi Inagaki, Valentin Valtchev, Georgi N. Vayssilov, Defect Formation, T-Atom Substitution and Adsorption of Guest Molecules in MSE-Type Zeolite Framework—DFT Modeling, Molecules, vol:26, issue:23, 2021, pages:7296-0, doi:https://doi.org/10.3390/molecules26237296, Ref, Web of Science, International, PhD
|
2021
|
|
18
|
Margarita Popova, Neli Koseva, Ivalina Trendafilova, Hristina Lazarova, Violeta Mitova, Judith Mihály, Denitsa Momekova, Spiro Konstantinov, Iskra Z. Koleva, Petko St. Petkov, Georgi N. Vayssilov, Hristiyan A. Aleksandrov, Ágnes Szegedi, Design of PEG-modified magnetic nanoporous silica based miltefosine delivery system: Experimental and theoretical approaches, Microporous and Mesoporous Materials, vol:310, 2021, pages:110664-0, doi:10.1016/j.micromeso.2020.110664, Ref, Web of Science, Web of Science Quartile: Q1 (2021), SCOPUS Quartile: Q1 (2021), International
|
2021
|
|
19
|
M. Y. Mihaylov, V. R. Zdravkova, E. Z. Ivanova, H. A. Aleksandrov, P. St. Petkov, G. N. Vayssilov, K. I. Hadjiivanov, Infrared spectra of surface nitrates: Revision of the current opinions based on the case study of ceria, Journal of Catalysis, vol:394, 2021, pages:245-258, doi:10.1016/j.jcat.2020.06.015, Ref, Web of Science, Web of Science Quartile: Q1 (2021), SCOPUS Quartile: Q1 (2021)
|
2021
|
|
20
|
Louwanda Lakiss, Cassandre Kouvatas, Jean-Pierre Gilson, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Nikolai Nesterenko, Svetlana Mintova, Valentin Valtchev, Unlocking the Potential of Hidden Sites in Faujasite: New Insights in a Proton Transfer Mechanism, Angewandte Chemie International Edition, vol:60, 2021, pages:26702-26709, doi:https://doi.org/10.1002/anie.202110107, Ref, Web of Science, International
|
2021
|
|
21
|
Koleva, Iskra Z., Aleksandrov, Hristiyan A., Vayssilov, Georgi N., Influence of the adsorption of CO on the electronic structure of platinum clusters and nanowires deposited on CeO2(111) and gamma-Al2O3(001) surfaces, CATALYSIS TODAY, vol:357, issue:SI, 2020, pages:442-452, ISSN (print):0920-5861, ISSN (online):1873-4308, doi:10.1016/j.cattod.2019.07.053
|
2020
|
|
22
|
Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Influence of the adsorption of CO on the electronic structure of platinum clusters and nanowires deposited on CeO2(111) and γ-Al2O3(001) surfaces, Catalysis Today, vol:357, 2020, pages:442-452, doi:10.1016/j.cattod.2019.07.053, Ref, Web of Science, IF (5.825 - 2019), Web of Science Quartile: Q1 (2020), SCOPUS, SJR (1.33 - 2019), SCOPUS Quartile: Q1 (2020)
|
2020
|
|
23
|
Iskra Z. Koleva, Hristiyan A. Aleksandrov, Konstantin M. Neyman, Georgi N. Vayssilov, Preferential location of zirconium dopants in cerium dioxide nanoparticles and the effects of doping on their reducibility: a DFT study, Physical Chemistry Chemical Physics, vol:22, 2020, pages:26568-26582, Ref, Web of Science, Web of Science Quartile: Q1 (2020), SCOPUS Quartile: Q1 (2020), International
|
2020
|
|
24
|
Mihail Y. Mihailov, Elena Z. Ivanova, Georgi N. Vayssilov, Konstantin I. Hadjiivanov, Revisiting ceria-NOx interaction: FTIR studies, Catalysis Today, vol:357, 2020, pages:613-620, Ref, Web of Science, IF (5.825 - 2019), Web of Science Quartile: Q1 (2020), SCOPUS, SJR (1.33 - 2019), SCOPUS Quartile: Q1 (2020)
|
2020
|
|
25
|
Konstantin Khivantsev, Nicholas R. Jaegers, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Libor Kovarik, Mark H. Engelhard, Feng Gao, Yong Wang, Georgi N. Vayssilov, János Szanyi, Stabilization of Super Electrophilic Pd+2 Cations in Small-Pore SSZ-13 Zeolite, The Journal of Physical Chemistry C, vol:124, issue:1, 2020, pages:309-321, doi:10.1021/acs.jpcc.9b06760, Ref, Web of Science, Web of Science Quartile: Q1 (2020), SCOPUS Quartile: Q1 (2020), International
|
2020
|
|
26
|
Margarita Popova, Neli Koseva, Ivalina Trendafilova, Hristina Lazarova, Violeta Mitova, Judith Mihály, Denitsa Momekova, Georgi Momekov, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Ágnes Szegedi, Tamoxifen Delivery System Based on PEGylated Magnetic MCM-41 Silica, Molecules, vol:25, 2020, pages:5129-0, doi:10.3390/molecules25215129, Ref, Web of Science, Web of Science Quartile: Q1 (2020), SCOPUS Quartile: Q1 (2020), International
|
2020
|
|
27
|
Nichapha Senamart, Siriphorn Buttha, Waenkaew Pantupho, Iskra Z. Koleva, Sirinuch Loiha, Hristiyan A. Aleksandrov, Jatuporn Wittayakun, Georgi N. Vayssilov, Characterization and temperature evolution of iron-containing species in HZSM-5 zeolite prepared from different iron sources, Journal of Porous Materials, том:26, 2019, стр.:1227-1240, doi:https://doi.org/10.1007/s10934-019-00718-w, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
28
|
Julien Grand, Siddulu Naidu Talapaneni, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Svetlana Mintova, Hydrophobic Tungsten-Containing MFI-Type Zeolite Films for Exhaust Gas Detection, ACS Applied Materials & Interfaces, том:11, брой:13, 2019, стр.:12914-12919, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
29
|
Ágnes Szegedi, Pavletta Shestakova, Ivalina Trendafilova, Judith Mihayi, Ivelina Tsacheva, Violeta Mitova, Mariya Kyulavska, Neli Koseva, Denitsa Momekova, Spiro Konstantinov, Hristiyan A. Aleksandrov, Petko St. Petkov, Iskra Z. Koleva, Georgi N. Vayssilov, Margarita Popova, Modified mesoporous silica nanoparticles coated by polymer complex as novel curcumin delivery carriers, Journal of Drug Delivery Science and Technology, том:49, 2019, стр.:700-712, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
30
|
Krassimira Yoncheva, Maria Merino, Aslihan Shenol, Nikolay T. Daskalov, Petko St Petkov, Georgi N. Vayssilov, Maria J. Garrido, Optimization and in-vitro/in-vivo evaluation of doxorubicin-loaded chitosan-alginate nanoparticles using a melanoma mouse model, International Journal of Pharmaceutics, том:556, 2019, стр.:1-8, doi: DOI: 10.1016/j.ijpharm.2018.11.070, Ref, IF, IF (3.862 - 2017), SCOPUS, SJR ( - 2018), в сътрудничество с чуждестранни учени
|
2019
|
|
31
|
Chalermpan Keawkumay, Wina Rongchapo, Narongrit Sosa, Suwit Suthirakun, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Jatuporn Wittayakun, Paraquat adsorption on NaY zeolite at various Si/Al ratios: A combined experimental and computational study, Materials Chemistry and Physics, том:238, 2019, стр.:121824-0, doi:10.1016/j.matchemphys.2019.121824, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
32
|
Artem Vityuk, Konstantin Khivantsev, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Oleg S. Alexeev, Michael D. Amiridis, Room-Temperature Ethene Hydrogenation Activity of Transition-Metal-Free HY Zeolites, ACS Catalysis, том:9, 2019, стр.:839-847, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
33
|
Oriol Piqué, Iskra Z. Koleva, Francesc Viñes, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Francesc Illas, Subsurface Carbon: A General Feature of Noble Metals, Angewandte Chemie International Edition, том:58, 2019, стр.:1744-1748, doi:10.1002/anie.201813037, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
34
|
Margarita Popova, Rositsa Mihaylova, Georgi Momekov, Denitsa Momekova, Hristina Lazarova, Ivalina Trendafilova, Violeta Mitova, Neli Koseva, Judith Mihályi, Pavletta Shestakova, Petko St. Petkov, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Spiro Konstantinov, Ágnes Szegedi, Verapamil delivery systems on the basis of mesoporous ZSM-5/KIT-6 and ZSM-5/SBA-15 polymer nanocomposites as a potential tool to overcome MDR in cancer cells, European Journal of Pharmaceutics and Biopharmaceutics, том:142, 2019, стр.:460-472, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2019
|
|
35
|
Konstantin Khivantsev, Nicholas R. Jaegers, Libor Kovarik, Jonathan C. Hanson, Franklin (Feng) Tao, Yu Tang, Xiaoyan Zhang, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Yong Wang, Feng Gao, János Szanyi, Achieving Atomic Dispersion of Highly Loaded Transition Metals in Small-Pore Zeolite SSZ-13: High-Capacity and High-Efficiency Low-Temperature CO and Passive NOx Adsorbers, Angewandte Chemie International Edition, том:130, 2018, стр.:16914-16919, Ref, Web of Science, SCOPUS Quartile: Q1 (2018), в сътрудничество с чуждестранни учени
|
2018
|
|
36
|
Margarita Popova, Ivalina Trendafilova, Ivelina Tsacheva, Violeta Mitova, Mariya Kyulavska, Neli Koseva, Judith Mihály, Denitsa Momekova, Georgi Momekov, Hristiyan A. Aleksandrov, Sylvia G. Marinova, Petko St. Petkov, Georgi N. Vayssilov, Agnes Szegedi, Amino-modified KIT-6 mesoporous silica/polymer composites for quercetin delivery: Experimental and theoretical approaches, Microporous and Mesoporous Materials, том:270, 2018, стр.:40-47, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2018
|
|
37
|
E.D. Ilieva, G. P. Petrova, R. D. Nikolova, G. N. Vayssilov, Computational elucidation of the reaction mechanism for synthesis of pyrrolidinedione derivatives via Nef-type rearrangement–cyclization reaction, RSC Advances , том:8, 2018, стр.:3178-3188, Ref, Web of Science
|
2018
|
|
38
|
S. K. Kolev, P. St. Petkov, M. A. Rangelov, D. V. Trifonov, T. I. Milenov, G. N. Vayssilov, Interaction of Na+, K+, Mg2+ and Ca2+ Counter Cations with RNA, Metallomics, том:10, 2018, стр.:659-678, Ref, Web of Science
|
2018
|
|
39
|
Mihail Y. Mihaylov, Elena Z. Ivanova, Hristiyan A. Aleksandrov, Petko St. Petkov, Georgi N. Vayssilov, Konstantin I. Hadjiivanov, Species formed during NO adsorption and NO+O2 co-adsorption on ceria: A combined FTIR and DFT study, Molecular Catalysis, том:451, 2018, стр.:114-124, doi:https://doi.org/10.1016/j.mcat.2017.11.030, Ref, IF, IF (4.21 - 2018)
|
2018
|
|
40
|
Hristiyan A. Aleksandrov, Iskra Z. Koleva, Konstantin M. Neyman, Tatyana T. Tabakova, Georgi N. Vayssilov, Structure and reducibility of doped by yttrium cerium dioxide nanoparticles and (111) surface, RSC Advances, том:8, 2018, стр.:33728-33741, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2018
|
|
41
|
Aleksandrov, Hristiyan A., Koleva, Iskra Z., Neyman, Konstantin M., Tabakova, Tatyana T., Vayssilov, Georgi N., Structure and reducibility of yttrium-doped cerium dioxide nanoparticles and (111) surface, RSC ADVANCES, vol:8, issue:59, 2018, pages:33728-33741, ISSN (print):2046-2069, doi:10.1039/c8ra07014h
|
2018
|
|
42
|
Hristiyan A. Aleksandrov, Sergey M. Kozlov, Georgi N. Vayssilov, Konstantin M. Neyman, Approaching complexity of alkyl hydrogenation on Pd via density-functional modelling, Physical Chemistry Chemical Physics, том:19, 2017, стр.:21514-21521, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2017
|
|
43
|
Koleva, Iskra Z., Aleksandrov, Hristiyan A., Vayssilov, Georgi N., Decomposition behavior of platinum clusters supported on ceria and gamma-alumina in the presence of carbon monoxide, CATALYSIS SCIENCE & TECHNOLOGY, vol:7, issue:3, 2017, pages:734-742, ISSN (print):2044-4753, ISSN (online):2044-4761, doi:10.1039/c6cy02586b
|
2017
|
|
44
|
Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Decomposition behavior of platinum clusters supported on ceria and γ-alumina in the presence of carbon monoxide, Catalysis Science & Technology, том:7, 2017, стр.:734-742, Ref, Web of Science, PhD
|
2017
|
|
45
|
Hristiyan A. Aleksandrov, Nikolaos Pegios, Regina Palkovits, Kalin Simeonov, Georgi N. Vayssilov, Elucidation of the higher coking resistance of small versus large nickel nanoparticles in methane dry reforming via computational modeling, Catalysis Science & Technology, том:7, 2017, стр.:3339-3347, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2017
|
|
46
|
Velina K. Markova, Georgi N. Vayssilov, Alexander Genest, Notker Rösch, Ethene hydrogenation on zeolite-supported rhodium clusters. A mechanistic study by density functional and microkinetic modeling, Applied Catalysis A: General , том:543, 2017, стр.:201-208, Ref, IF, IF (4.339 - ), в сътрудничество с чуждестранни учени
|
2017
|
|
47
|
Julien Grand, Siddulu Naidu Talapaneni, Aurélie Vicente, Christian Fernandez, Eddy Dib, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Richard Retoux, Philippe Boullay, Jean-Pierre Gilson, Valentin Valtchev, Svetlana Mintova, One-pot synthesis of silanol-free nanosized MFI zeolite, Nature Materials, том:16, 2017, стр.:1010-1015, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2017
|
|
48
|
Konstantin Khivantsev, Artem Vityuk, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Douglas Blom, Oleg S. Alexeev, Michael D. Amiridis, Synthesis, Modeling, and Catalytic Properties of HY Zeolite-Supported Rhodium Dinitrosyl Complexes, ACS Catalysis, том:7, 2017, стр.:5965-5982, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2017
|
|
49
|
V. K. Markova, G. N. Vayssilov, A. Genest, N. Rösch, Adsorption and transformations of ethene on hydrogenated rhodium clusters in faujasite-type zeolite. A computational study, Catalysis Science & Technology , том:6, 2016, стр.:1726-1736, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2016
|
|
50
|
Hristiyan A. Aleksandrov, Konstantin M. Neyman, Konstantin I. Hadjiivanov, Georgi N. Vayssilov, Can the state of platinum species be unambiguously determined by the stretching frequency of an adsorbed CO probe molecule?, Physical Chemistry Chemical Physics, том:18, 2016, стр.:22108-22121, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2016
|
|
51
|
Margarita Popova, Ivalina Trendafilova, Agnes Szegedi, Judith Mihaly, Peter Nemeth, Sylvia G. Marinova, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Experimental and theoretical study of quercetin complexes formed on pure silica and Zn-modified mesoporous MCM-41 and SBA-16 materials, Microporous and Mesoporous Materials, том:228, 2016, стр.:256-265, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2016
|
|
52
|
Olaf Brummel, Fabian Waidhas, Firas Faisal, Roman Fiala, Mykhailo Vorokhta, Ivan Khalakhan, Martin Dubau, Alberto Figueroba, Gabor Kovacs, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Sergey M. Kozlov, Konstantin M. Neyman, Vladimír Matolín, Jörg Libuda, Stabilization of Small Platinum Nanoparticles on Pt–CeO2 Thin Film Electrocatalysts During Methanol Oxidation, The Journal of Physical Chemistry C , том:120, 2016, стр.:19723-19736, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2016
|
|
53
|
Konstantin Khivantsev, Artem Vityuk, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Oleg S. Alexeev, Michael D. Amiridis, Effect of Si/Al Ratio and Rh Precursor Used on the Synthesis of HY Zeolite-Supported Rhodium Carbonyl Hydride Complexes, The Journal of Physical Chemistry C, том:119, брой:30, 2015, стр.:17166-17181, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2015
|
|
54
|
Mihail Y. Mihaylov, Elena Z. Ivanova, Hristiyan A. Aleksandrov, Petko St. Petkov, Georgi N. Vayssilov, Konstantin I. Hadjiivanov, Formation of N3– during interaction of NO with reduced ceria, Chemical Communications , том:51, 2015, стр.:5668-5671, Ref, IF, IF (6.78 - 2015), Web of Science Quartile: Q1 (2015)
|
2015
|
|
55
|
Mihaylov, Mihail Y., Ivanova, Elena Z., Aleksandrov, Hristiyan A., St Petkov, Petko, Vayssilov, Georgi N., Hadjiivanov, Konstantin I., FTIR and density functional study of NO interaction with reduced ceria: Identification of N-3(-) and NO2- as new intermediates in NO conversion, APPLIED CATALYSIS B-ENVIRONMENTAL, vol:176, 2015, pages:107-119, ISSN (print):0926-3373, ISSN (online):1873-3883, doi:10.1016/j.apcatb.2015.03.054
|
2015
|
|
56
|
Mihail Y. Mihaylov, Elena Z. Ivanova, Hristiyan A. Aleksandrov, Petko St. Petkov, Georgi N. Vayssilov, Konstantin I. Hadjiivanov, FTIR and density functional study of NO interaction with reduced ceria: Identification of N3− and NO2− as new intermediates in NO conversion, Applied Catalysis B Environmental , том:176–177, 2015, стр.:107-119, Ref, IF, IF (8.68 - 2015), Web of Science Quartile: Q1 (2015)
|
2015
|
|
57
|
V. K. Markova, G. N. Vayssilov, N. Rösch, Hydrogen Adsorption on Small Zeolite-Supported Rhodium Clusters. A Density Functional Study, The Journal of Physical Chemistry C , 2015, Ref, Web of Science, в сътрудничество с чуждестранни учени, PhD
|
2015
|
|
58
|
H. Iglev, S. K. Kolev, H. Rossmadl, P. St. Petkov, G. N. Vayssilov, Hydrogen Atom Transfer from Water or Alcohols Activated by Presolvated Electrons, Journal of Physical Chemistry Letters , 2015, Ref, Web of Science, в сътрудничество с чуждестранни учени, PhD
|
2015
|
|
59
|
Kok-Hou Tan, Hussein Awala, Rino R. Mukti, Ka-Lun Wong, Baptiste Rigaud, Tau Chuan Ling, Hristiyan A. Aleksandrov, Iskra Z. Koleva, Iskra Z. Koleva, Georgi N. Vayssilov, Svetlana Mintova, Eng-Poh Ng, Inhibition of Palm Oil Oxidation by Zeolite Nanocrystals, Journal of Agricultural and Food Chemistry , том:63, 2015, стр.:4655-4663, Ref, Web of Science, в сътрудничество с чуждестранни учени, PhD
|
2015
|
|
60
|
Koleva, Iskra Z., Aleksandrov, Hristiyan A., Vayssilov, Georgi N., Duarte, Renata, van Bokhoven, Jeroen A., Relative stability and reducibility of CeO2 and Rh/CeO2 species on the surface and in the cavities of gamma-Al2O3: a periodic DFT study, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol:17, issue:34, 2015, pages:22389-22401, ISSN (print):1463-9076, ISSN (online):1463-9084, doi:10.1039/c5cp02547h
|
2015
|
|
61
|
Iskra Z. Koleva, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Renata Duarte, Jeroen A. van Bokhoven, Relative stability and reducibility of CeO2 and Rh/CeO2 species on the surface and in the cavities of γ-Al2O3: a periodic DFT study, Physical Chemistry Chemical Physics, том:17, 2015, стр.:22389-22401, Ref, Web of Science, в сътрудничество с чуждестранни учени, PhD
|
2015
|
|
62
|
Hristiyan A. Aleksandrov, Konstantin M. Neyman, Georgi N. Vayssilov, The structure and stability of reduced and oxidized mononuclear platinum species on nanostructured ceria from density functional modeling, Physical Chemistry Chemical Physics , том:17, 2015, стр.:14551-14560, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2015
|
|
63
|
Artem Vityuk, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Shuguo Ma, Oleg S. Alexeev, Michael D. Amiridis, Effect of Si/Al ratio on the nature and reactivity of HY zeolite-supported rhodium dicarbonyl complexes, The Journal of Physical Chemistry C , том:118, 2014, стр.:26772-26788, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2014
|
|
64
|
Hristiyan A. Aleksandrov, Sergey M. Kozlov, Swetlana Schauermann, Georgi N. Vayssilov, Konstantin M. Neyman, How Absorbed Hydrogen Affects the Catalytic Activity of Transition Metals, Angewandte Chemie International Edition , том:53, 2014, стр.:13371-13375, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2014
|
|
65
|
M. Popova, A. Szegedi, K. Yoncheva, S. Konstantinov, G. P. Petrova, H. A. Aleksandrov, G. N. Vayssilov, P. Shestakova, New method for preparation of delivery systems of poorly soluble drugs on the basis of functionalized mesoporous MCM-41 nanoparticles, Microporous and Mesoporous Materials , том:198, 2014, стр.:247-255, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2014
|
|
66
|
C.-c. Chiu, G. N. Vayssilov, A. Genest, А. Borgna, N. Rösch, Predicting Adsorption Enthalpies on Silicalite and HZSM-5: A Benchmark Study on DFT Strategies Addressing Dispersion Interactions, Journal of Computational Chemistry, 2014, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2014
|
|
67
|
N. I. Petkova, R. D. Nikolova, K. L. Kostov, T. Mineva, G. N. Vayssilov, Theoretical and Experimental Local Reactivity Parameters of 3-substituted Coumarin Derivatives, The Journal of Physical Chemistry A , 2014, Ref, Web of Science
|
2014
|
|
68
|
Nevena I. Petkova, Rositca D. Nikolova, Krassimir L. Kostov, Tzonka Mineva, Georgi N. Vayssilov, Theoretical and Experimental Local Reactivity Parameters of
3‑Substituted Coumarin Derivatives, The Journal of Physical Chemistry A, том:118, 2014, стр.:11062-11073, doi:dx.doi.org/10.1021/jp508432c, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2014
|
|
69
|
G. N. Vayssilov, Jee, Bettina, Petkov, Petko St., Vayssilov, Georgi N., Heine, Thomas, Hartmann, Martin, Poeppl, Andreas, A Combined Pulsed Electron Paramagnetic Resonance Spectroscopic and DFT Analysis of the (CO2)-C-13 and (CO)-C-13 Adsorption on the Metal-Organic Framework Cu2.97Zn0.03(btc)(2), JOURNAL OF PHYSICAL CHEMISTRY C, vol:117, issue:16, 2013, pages:8231-8240, ISSN (print):1932-7447, ISSN (online):1932-7455, doi:10.1021/jp4003033
|
2013
|
|
70
|
B. Jee, P. St. Petkov, G. N. Vayssilov, T. Heine, M. Hartmann, A. Pöppl, A Combined Pulsed Electron Paramagnetic Resonance Spectroscopic and DFT Analysis of the 13CO2 and 13CO Adsorption in the Metal-Organic Framework Cu2.97Zn0.03(btc)2, The Journal of Physical Chemistry C, том:117, 2013, стр.:8231-8240, Ref, Web of Science
|
2013
|
|
71
|
S. K. Kolev, P. St. Petkov, M. A. Rangelov, G. N. Vayssilov, Ab Initio Molecular Dynamics of Na+ and Mg2+ Countercations at the Backbone of RNA in Water Solution, ACS Chemical Biology, 2013, Ref, Web of Science, PhD
|
2013
|
|
72
|
P. St. Petkov, G. N. Vayssilov, J. Liu, O. Shekhah, Y. Wang, C. Wöll, T. Heine, „Defects in MOFs: A Thorough Characterization”, ChemPhysChem, том:13, 2012, стр.:2025-2029, Ref, Web of Science
|
2012
|
|
73
|
G. N. Vayssilov, G. P. Petrova, E. A. Ivanova Shor, V. A. Nasluzov, A. M. Shor, P. St. Petkov, N. Rösch, „Reverse hydrogen spillover on and hydrogenation of supported metal clusters: insights from computational model studies” (Perspective), Physical Chemistry Chemical Physics, том:14, 2012, стр.:5879-5890, Ref, Web of Science
|
2012
|
|
74
|
B. Lukose, B. Supronowicz, P. St. Petkov, J. Frenzel, A. B. Kuc, G. Seifert, G. N. Vayssilov, T. Heine, „Structural properties of metal-organic frameworks within the density-functional based tight-binding method”, Physica status solidi (b), том:249, 2012, стр.:335-342, Ref, Web of Science
|
2012
|
|
75
|
Tsekov, Roumen, G. N. Vayssilov, Bayesian approach to electron correlation in density functional theory, ANNALEN DER PHYSIK, vol:524, issue:12, 2012, pages:822-825, ISSN (print):0003-3804, doi:10.1002/andp.201200101
|
2012
|
|
76
|
Hristiyan A. Aleksandrov, Elena A. Ivanova Shor, Alexei M. Shor, Vladimir A. Nasluzov, Georgi N. Vayssilov, Notker Rösch, Cationic zinc species in ZSM-5 zeolites: structure and stability from embedded cluster modeling, Soft Materials, том:10, 2012, стр.:216-234, Ref, Web of Science
|
2012
|
|
77
|
Hristiyan A. Aleksandrov, Petko St. Petkov, Georgi N. Vayssilov, Computational Modeling of Coordination Chemistry of Transition Metal Cations in Zeolites and in Metal-organic Frameworks, Current Physical Chemistry, том:2, 2012, стр.:189-199, Ref, Web of Science
|
2012
|
|
78
|
P. St. Petkov, H. A. Aleksandrov, V. Valtchev, G. N. Vayssilov, Framework stability of heteroatom substituted forms of large pore Ge-silicate molecular sieves: the case of ITQ-44, Chemistry of Materials, том:24, 2012, стр.:2509-2518, Ref, Web of Science
|
2012
|
|
79
|
Petkov, Petko St., Aleksandrov, Hristiyan A., Valtchev, Valentin, Vayssilov, Georgi N., Framework Stability of Heteroatom-Substituted Forms of Extra-Large-Pore Ge-Silicate Molecular Sieves: The Case of ITQ-44, CHEMISTRY OF MATERIALS, vol:24, issue:13, 2012, pages:2509-2518, ISSN (print):0897-4756, doi:10.1021/cm300861e
|
2012
|
|
80
|
Aleksandrov, Hristiyan A., Zdravkova, Videlina R., Mihaylov, Mihail Y., St Petkov, Petko, Vayssilov, Georgi N., Hadjiivanov, Konstantin I., Precise Identification of the Infrared Bands of the Polycarbonyl Complexes on Ni-MOR Zeolite by (CO)-C-12-O-16-(CO)-C-13-O-18 Coadsorption and Computational Modeling, JOURNAL OF PHYSICAL CHEMISTRY C, vol:116, issue:43, 2012, pages:22823-22831, ISSN (print):1932-7447, doi:10.1021/jp304972u
|
2012
|
|
81
|
H. A. Aleksandrov, V. R. Zdravkova, M. Y. Mihaylov, P. St. Petkov, G. N. Vayssilov, K. I. Hadjiivanov, Precise Identification of the Infrared Bands of the Polycarbonyl Complexes on Ni–MOR Zeolite by 12C16O–13C18O Coadsorption and Computational Modeling, The Journal of Physical Chemistry C, том:116, 2012, стр.:22823-22831, Ref
|
2012
|
|
82
|
Y. Lykhach, V. Johanek, H. A. Aleksandrov, S. M. Kozlov, M. Happel, T. Skala, P. St. Petkov, N. Tsud, G. N. Vayssilov, K. M. Neyman, Water Chemistry on Model Ceria and Pt/Ceria Catalysts, The Journal of Physical Chemistry C, том:116, 2012, стр.:12103-12113, в сътрудничество с чуждестранни учени
|
2012
|
|
83
|
Hristiyan A. Aleksandrov, Petko St. Petkov, Georgi N. Vayssilov, Computational evaluation of the capability of transition metal exchanged zeolites for complete purification of hydrogen for fuel cell applications: The cheapest performs the best, Energy and Environmental Science, том:4, 2011, стр.:1879-1885, Ref, IF, IF (10.48 - 2011), Web of Science Quartile: Q1 (2011)
|
2011
|
|
84
|
K. Chakarova, G. Petrova, M. Dimitrov, L. Dimitrov, G. N. Vayssilov, T. Tsoncheva, K. Hadjiivanov, Coordination state of Cu+ ions in Cu-[Al]MCM-41, Applied Catalysis B: Environmental , том:106, 2011, стр.:186-194, Ref, Web of Science
|
2011
|
|
85
|
G. N. Vayssilov, A. Migani, K. Neyman, Density Functional Modeling of the Interactions of Platinum Clusters with CeO2 Nanoparticles of Different Size, The Journal of Physical Chemistry C, том:115, 2011, стр.:16081-16086, Ref, Web of Science
|
2011
|
|
86
|
S. K. Kolev, P. St. Petkov, M. A. Rangelov, G. N. Vayssilov, Density Functional Study of Hydrogen Bond Formation between Methanol and Organic Molecules Containing Cl, F, NH2, OH, and COOH Functional Groups, The Journal of Physical Chemistry A, том:115, 2011, стр.:14054-14068, Ref, Web of Science, PhD
|
2011
|
|
87
|
М. A. Rangelov, V. M. Yomtova, V. M. Yomtova, G. N. Vayssilov, Determination of the optimal position of adjacent proton-donor centers for the activation or inhibition of peptide bond formation – A computational model study, Journal of Molecular Graphics and Modelling, том:30, 2011, стр.:10-14
|
2011
|
|
88
|
A. Bruix, A. Migani, G. N. Vayssilov, K. M. Neyman, J. Libuda, F. Illas, Effects of deposited Pt particles on the reducibility of CeO2(111), Physical Chemistry Chemical Physics, том:13, 2011, стр.:11384-11392, Ref, Web of Science
|
2011
|
|
89
|
G. P. Petrova, G. N. Vayssilov, B. Galabov, Enhanced reactivity of carbonyl compounds on MgO surface: A computational study, Journal of Molecular Catalysis A: Chemical, том:342–343, 2011, стр.:67-73, Ref, Web of Science
|
2011
|
|
90
|
Notker Rösch, Galina P. Petrova, Petko St. Petkov, Alexander Genest, Sven Krüger, Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Impurity Atoms on Small Transition Metal Clusters. Insights from Density Functional Model Studies, Topics in Catalysis, том:54, 2011, стр.:363-377, Ref, IR , SCOPUS, SJR (2.972 - 2011), в сътрудничество с чуждестранни учени
|
2011
|
|
91
|
G. Petrova, G. N. Vayssilov, N. Rosh, Interaction of ethene and ethyne with bare and hydrogenated Ir4 clusters. A density functional study , Catalysis Science and Technology, том:1, 2011, стр.:958-970, Ref, в сътрудничество с чуждестранни учени
|
2011
|
|
92
|
G. N. Vayssilov, M. Mihaylov, P. St. Petkov, K. I. Hadjiivanov, К. M. Neyman, Reassignment of the Vibrational Spectra of Carbonates, Formates, and Related Surface Species on Ceria: A Combined Density Functional and Infrared Spectroscopy Investigation, The Journal of Physical Chemistry C, том:115, 2011, стр.:23435-23454, Ref, Web of Science
|
2011
|
|
93
|
G. N. Vayssilov, Y. Lykhach, A. Migani,, T. Staudt, G. P. Petrova, N. Tsud, A. Bruix, F. Illas, K. C. Prince, etc., Support Nanostructure Boosts Oxygen Transfer to Catalytically Active Platinum Nanoparticles, Nature Materials, том:10, 2011, стр.:310-315, Ref, Web of Science
|
2011
|
|
94
|
М. A. Rangelov, V. M. Yomtova, G. P. Petrova, G. N. Vayssilov, „Catalytic Role of Vicinal OH in Ester Aminolysis: Proton Shuttle versus Hydrogen Bond Stabilization”, Journal of Organic Chemistry, том:75, 2010, стр.:6782-6792
|
2010
|
|
95
|
M. A. Rangelov, G. P. Petrova, V. M. Yomtova, G. N. Vayssilov, „Hierarchical Approach to Conformational Search and Selection of Computational Method in Modeling the Mechanism of Ester Ammonolysis”, Journal of Molecular Graphics and Modelling, том:29, 2010, стр.:246-255
|
2010
|
|
96
|
G. P. Petrova, G. N. Vayssilov, N. Rösch, „Redox Behavior of Small Metal Clusters with Respect to Hydrogen. The Effect of the Cluster Charge from Density Functional Results”, Physical Chemistry Chemical Physics, том:12, 2010, стр.:11015-11020
|
2010
|
|
97
|
P. St. Petkov, G. P. Petrova, G. N. Vayssilov, N. Rösch, „Saturation of Small Supported Metal Clusters by Adsorbed Hydrogen. A Computational Study on Tetrahedral Models of Rh4, Ir4, and Pt4”, Journal of Physical Chemistry C, том:114, 2010, стр.:8500-8506, Ref, в сътрудничество с чуждестранни учени
|
2010
|
|
98
|
A. Migani, G. N. Vayssilov, S. T. Bromley, F. Illas, K. M. Neyman, Dramatic reduction of the oxygen vacancy formation energy in ceria particles: a possible key to their remarkable reactivity at the nanoscale , Journal of Materials Chemistry, том:20, 2010, стр.:10535-10546, Ref, в сътрудничество с чуждестранни учени
|
2010
|
|
99
|
A. Migani, G. N. Vayssilov, S. T. Bromley, F. Illas, K. M. Neyman, Greatly facilitated oxygen vacancy formation in ceria nanocrystallites , Chemical Communications, том:46, 2010, стр.:5936-5938, Ref, в сътрудничество с чуждестранни учени
|
2010
|
|
100
|
G. N. Vayssilov, St Petkov, Petko, Petrova, Galina P., Vayssilov, Georgi N., Roesch, Notker, Saturation of Small Supported Metal Clusters by Adsorbed Hydrogen. A Computational Study on Tetrahedral Models of Rh-4, Ir-4, and Pt-4, JOURNAL OF PHYSICAL CHEMISTRY C, vol:114, issue:18, 2010, pages:8500-8506, ISSN (print):1932-7447, ISSN (online):1932-7455, doi:10.1021/jp1014274
|
2010
|
|
101
|
Hristiyan A. Aleksandrov, Georgi N. Vayssilov, 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, Catalysis Today, том:152, 2010, стр.:78-87, Ref, Web of Science
|
2010
|
|
102
|
A. M. Shor, E. A. Ivanova Shor, S. Laletina, V. A. Nasluzov, G. N. Vayssilov, N. Rösch, „Effect of the size of the quantum region in a hybrid embedded-cluster scheme for zeolite systems”, Chemical Physics, том:363, 2009, стр.:33-41, Ref, в сътрудничество с чуждестранни учени
|
2009
|
|
103
|
P. St. Petkov, G. N. Vayssilov, S. Krüger, N. Rösc, „CO Coordination at XNi4 Clusters with Impurities X = H, C, O. A Density Functional Study” , Journal of Physical Chemistry A, том:112, 2008, стр.:8523-8528, Ref, в сътрудничество с чуждестранни учени
|
2008
|
|
104
|
P. Petkov, G. N. Vayssilov, S. Krueger, N. Roesch, „Density functional study of Ni6 clusters containing impurity atoms”, Chemical Physics, том:348, 2008, стр.:61-68, Ref, в сътрудничество с чуждестранни учени
|
2008
|
|
105
|
G. P. Petrova, G. N. Vayssilov, N. Rösch, „Hydrogen adsorption on zeolite-supported tetrairidium clusters. Thermodynamic modeling from density functional calculations”, Journal of Physical Chemistry C, том:112, 2008, стр.:18572-18577, Ref, в сътрудничество с чуждестранни учени
|
2008
|
|
106
|
Petkov, Petko St., Vayssilov, Georgi N., Krueger, Sven, Roesch, Notker, Density functional study of Ni-6 clusters containing impurity atoms, CHEMICAL PHYSICS, vol:348, issue:1-3, 2008, pages:61-68, ISSN (print):0301-0104, ISSN (online):1873-4421, doi:10.1016/j.chemphys.2008.02.017
|
2008
|
|
107
|
G. P. Petrova, G. N. Vayssilov, N. Rösch, „Density Functional Modeling of Reverse Hydrogen Spillover on Zeolite-Supported Tetrairidum Clusters” , Chemical Physics Letters, том:444, 2007, стр.:215-219, Ref, в сътрудничество с чуждестранни учени
|
2007
|
|
108
|
G. P. Petrova, G. N. Vayssilov, N. Rösch, „Density Functional Study of Hydrogen Adsorption on Tetrairidium Supported on Hydroxylated and Dehydroxylated Zeolite Surfaces”, Journal of Physical Chemistry C, том:111, 2007, стр.:14484-14492, Ref, в сътрудничество с чуждестранни учени
|
2007
|
|
109
|
A. M. Shor, E. A. Ivanova Shor, V. A. Nasluzov, G. N. Vayssilov, N. Rösch, „First Hybrid Embedding Scheme for Polar Covalent Materials Using an Extended Border Region to Minimize Boundary Effects on the Quantum Region”, Journal of Chemical Theory and Computation, том:3, 2007, стр.:2290-2300, Ref, в сътрудничество с чуждестранни учени
|
2007
|
|
110
|
P. S. Petkov, G. N. Vayssilov, S. Krüger, N. Rösch, „Influence of Single Impurity Atoms on the Structure, Electronic, and Magnetic Properties of Ni5 Clusters , Journal of Physical Chemistry A, том:111, 2007, стр.:2067-2076, Ref, в сътрудничество с чуждестранни учени
|
2007
|
|
111
|
E. A. Ivanova Shor, V. A. Nasluzov, A. M. Shor, G. N. Vayssilov, N. Rösch, „Reverse Hydrogen Spillover onto Zeolite-Supported Metal Clusters: An Embedded Cluster Density Functional Study of Models M6 (M = Rh, Ir, Au)”, Journal of Physical Chemistry C, том:111, 2007, стр.:12340-12351, Ref, в сътрудничество с чуждестранни учени
|
2007
|
|
112
|
Petrova, Galina P., Vayssilov, Georgi N., Roesch, Notker, Density functional modeling of reverse hydrogen spillover on zeolite-supported tetrairidium clusters, CHEMICAL PHYSICS LETTERS, vol:444, issue:4-6, 2007, pages:215-219, ISSN (print):0009-2614, ISSN (online):1873-4448, doi:10.1016/j.cplett.2007.07.056
|
2007
|
|
113
|
Nevena I. Petkova, R. D. Nikolova, Bojilova A. G., G. N. Vayssilov, Influence of BH3 and alkaline cation released from the reduction agent on a tandem reduction/acylation reaction – a computational study, Int. J. Quant. Chem., том:107, 2007, стр.:1814-1825, Ref, Web of Science
|
2007
|
|
114
|
G. N. Vayssilov, Petkov, Petko St., Vayssilov, Georgi N., Krueger, Sven, Roesch, Notker, Influence of single impurity atoms on the structure, electronic, and magnetic properties of Ni-5 clusters, JOURNAL OF PHYSICAL CHEMISTRY A, vol:111, issue:11, 2007, pages:2067-2076, ISSN (print):1089-5639, ISSN (online):1520-5215, doi:10.1021/jp0675431
|
2007
|
|
115
|
Shor, Elena A. Ivanova, Nasluzov, Vladimir A., Shor, Aleksey M., Vayssilov, Georgi N., Roesch, Notker, Reverse hydrogen spillover onto zeolite-supported metal clusters: An embedded cluster density functional study of models M-6 (M = Rh, Ir, or Au), JOURNAL OF PHYSICAL CHEMISTRY C, vol:111, issue:33, 2007, pages:12340-12351, ISSN (print):1932-7447, ISSN (online):1932-7455, doi:10.1021/jp0711287
|
2007
|
|
116
|
Еlena Ivanova, Mihail Mihaylov, Hristiyan A. Aleksandrov, Marco Daturi, Frederic Thibault-Starzyk, Georgi N. Vayssilov, Notker Rösch, Konstantin I. Hadjiivanov, Unusual Carbonyl-Nitrosyl Complexes of Rh2+ in Rh-ZSM-5: A Combined FTIR Spectroscopy and Computational Study, The Journal of Physical Chemistry C, том:111, 2007, стр.:10412-10418, Ref, Web of Science
|
2007
|
|
117
|
M. A. Rangelov, G. N. Vayssilov, V. M. Yomtova, D. D. Petkov, „Quantum Chemical Model Study of the Acyl Migration in 2`(3`)-Formylnucleosides”, Journal of the American Chemical Society, том:128, 2006, стр.:4964-4965
|
2006
|
|
118
|
P. St. Petkov, G. N. Vayssilov, S. Krüger, N. Rösch, „Structure, stability, electronic and magnetic properties of Ni4 clusters containing impurity atoms”, Physical Chemistry Chemical Physics, том:8, 2006, стр.:1282-1291, Ref, в сътрудничество с чуждестранни учени
|
2006
|
|
119
|
Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Notker Rösch, Heterolytic dissociation and recombination of H2 over Zn,H-ZSM-5 zeolites - a density functional model study, Journal of Molecular Catalysis A: Chemical, том:256, 2006, стр.:149-155, Ref, Web of Science
|
2006
|
|
120
|
M. A. Rangelov, G. N. Vayssilov, D. D. Petkov, Quantum chemical model study of the acyl migration in 2′(3′)‐formylnucleosides, International Journal of Quantum Chemistry, том:106, 2006, стр.:1346-1356
|
2006
|
|
121
|
St Petkov, P, Vayssilov, GN, Kruger, S, Structure, stability, electronic and magnetic properties of Ni-4 clusters containing impurity atoms, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol:8, issue:11, 2006, pages:1282-1291, ISSN (print):1463-9076, ISSN (online):1463-9084, doi:10.1039/b518175e
|
2006
|
|
122
|
Rangelov, MA, Vayssilov, GN, Yomtova, VM, Petkov, DD, The syn-oriented 2-OH provides a favorable proton transfer geometry in 1,2-diol monoester aminolysis: Implications for the ribosome mechanism, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, vol:128, issue:15, 2006, pages:4964-4965, ISSN (print):0002-7863, ISSN (online):1520-5126, doi:10.1021/ja060648x
|
2006
|
|
123
|
Nevena I. Petkova, G. N. Vayssilov, Nikolova R.D., Bojilova A. G., Theoretical elucidation of the regioselectivity in a tandem 1,4-hydride addition / acylation of diethylphosphonocoumarin, J. Mol. Struct. THEOCHEM , том:759, 2006, стр.:177-187, Ref, Web of Science
|
2006
|
|
124
|
R. Ch. Deka, V. A. Nasluzov, E. A. Ivanova Shor, A. M. Shor, G. N. Vayssilov, N. Rösch, „Comparison of All Sites for Ti Substitution in Zeolite TS-1 by an Accurate Embedded Cluster Method”, Journal of Physical Chemistry B, том:109, 2005, стр.:24304-24310, в сътрудничество с чуждестранни учени
|
2005
|
|
125
|
E. A. Ivanova Shor, A. M. Shor, V. A. Nasluzov, G. N. Vayssilov, N. Rösch, „Effects of the aluminum content of a zeolite framework: A DFT/MM hybrid approach based on cluster models embedded in an elastic polarizable environment”, Journal of Chemical Theory and Computation, том:1, 2005, стр.:459-471, в сътрудничество с чуждестранни учени
|
2005
|
|
126
|
G. N. Vayssilov, N. Rösch, „Reverse Hydrogen Spillover in Supported Subnanosize Clusters of the Metals of Groups 8 to 11. A Computational Model Study”, Physical Chemistry Chemical Physics, том:7, 2005, стр.:4019-4026, в сътрудничество с чуждестранни учени
|
2005
|
|
127
|
C. Bussai, S. Krüger, G. N. Vayssilov, N. Rösch, „The Cluster Ir4 and its Interaction with a Hydrogen Impurity. A Density Functional Study”, Physical Chemistry Chemical Physics, том:7, 2005, стр.:2656-2663, в сътрудничество с чуждестранни учени
|
2005
|
|
128
|
M. A. Rangelov, G. N. Vayssilov, V. M. Yomtova, D. D. Petkov, „Theoretical Study of the o-OH Participation in Catechol Ester Ammonolysis”, Organic and Biomolecular Chemistry, том:3, 2005, стр.:737-744
|
2005
|
|
129
|
Deka, RC, Nasluzov, VA, Shor, EAI, Shor, AM, Vayssilov, GN, Comparison of all sites for Ti substitution in zeolite TS-1 by an accurate embedded-cluster method, JOURNAL OF PHYSICAL CHEMISTRY B, vol:109, issue:51, 2005, pages:24304-24310, ISSN (print):1520-6106, ISSN (online):1520-5207, doi:10.1021/jp050056l
|
2005
|
|
130
|
Bussai, C, Kruger, S, Vayssilov, GN, The cluster Ir-4 and its interaction with a hydrogen impurity. A density functional study, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, vol:7, issue:13, 2005, pages:2656-2663, ISSN (print):1463-9076, ISSN (online):1463-9084
|
2005
|
|
131
|
Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Notker Rösch, Theoretical investigation of Zn-containing species in pores of ZSM-5 zeolites, Studies of Surface Science and Catalysis, том:158A, 2005, стр.:593-600, Ref, Web of Science
|
2005
|
|
132
|
G. N. Vayssilov, N. Rösch, „Free and Zeolite-Supported Hexarhodium Clusters Affected by Adsorbed Light Atoms”, Journal of Physical Chemistry B, том:108, 2004, стр.:180-192, в сътрудничество с чуждестранни учени
|
2004
|
|
133
|
K. M. Neyman, G. N. Vayssilov, N. Rösch, „Transition Metal Clusters and Supported Species with Metal-Carbon Bonds from First-Principles Quantum Chemistry”, Journal of Organometallic Chemistry, том:689, 2004, стр.:4384-4394, в сътрудничество с чуждестранни учени
|
2004
|
|
134
|
G. N. Vayssilov, Vayssilov, GN, Rosch, N, Free and zeolite-supported hexarhodium clusters with light impurity atoms, JOURNAL OF PHYSICAL CHEMISTRY B, vol:108, issue:1, 2004, pages:180-192, ISSN (print):1520-6106, doi:10.1021/jp036241l
|
2004
|
|
135
|
N. Rösch, V. A. Nasluzov, K. M. Neyman, G. Pacchioni, G. N. Vayssilov, Supported metal species and adsorption complexes on metal oxides and in zeolites: Density functional cluster, Computational Material Sciences , том:Chapter 11 , 2004, стр.:367-438, в сътрудничество с чуждестранни учени
|
2004
|
|
136
|
Hristiyan A. Aleksandrov, Georgi N. Vayssilov, Notker Rösch, Theoretical investigation of the coordination of N2 ligands to the cluster Ni3, The Journal of Physical Chemistry A, том:108, 2004, стр.:6127-6144, Ref, Web of Science, в сътрудничество с чуждестранни учени
|
2004
|
|
137
|
V. A. Nasluzov, E. A. Ivanova, A. M. Shor, G. N. Vayssilov, U. Birkenheuer, N. Rösch, „Elastic Polarizable Environment Cluster Embedding Approach for Covalent Oxides and Zeolites Based on a Density Functional Method”, Journal of Physical Chemistry B, том:107, 2003, стр.:2228-2241, в сътрудничество с чуждестранни учени
|
2003
|
|
138
|
G. N. Vayssilov, B. C. Gates, N. Rösch, „Oxidation of Supported Rhodium Clusters from Surface Hydroxyl Groups of the Support” , Angewandte Chemie, Int. Edition, том:42, 2003, стр.:1391-1394, в сътрудничество с чуждестранни учени
|
2003
|
|
139
|
N. Rösch, G. N. Vayssilov, K. M. Neyman, Host-Guest-Systems based on Nanoporous Crystals, Eds., Wiley-VCH, Weinheim, 2003, стр.:339-357, в сътрудничество с чуждестранни учени
|
2003
|
|
140
|
G. N. Vayssilov, Vayssilov, GN, Gates, BC, Rosch, N, Oxidation of supported rhodium clusters by support hydroxy groups, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, vol:42, issue:12, 2003, pages:1391-1394, ISSN (print):1433-7851, ISSN (online):1521-3773
|
2003
|
|
141
|
G. N. Vayssilov, N. Rösch, „A new interpretation of the IR bands of supported Rh(I) monocarbonyl complexes", Journal of the American Chemical Society, том:124, 2002, стр.:3783-3786, в сътрудничество с чуждестранни учени
|
2002
|
|
142
|
K. I. Hadjiivanov, G. N. Vayssilov, „Characterization of Oxide Surfaces and Zeolites by Carbon Monoxide as an IR Probe Molecule"
, Advances in Catalysis, том:47, 2002, стр.:307-511
|
2002
|
|
143
|
G. N. Vayssilov, N. Rösch, „Determination of the Basicity of Alkali-Exchanged Molecular Sieves", Physical Chemistry Chemical Physics, том:4, 2002, стр.:146-148, в сътрудничество с чуждестранни учени
|
2002
|
|
144
|
R. Nikolova, G. N. Vayssilov, N. Rodios, A. Boilova, Regio- and stereoselective [2+2] photodimerization of 3-substituted 2-alkoxy-2-oxo-2H-1,2-benzoxaphosphorines, Molecules, 2002, в сътрудничество с чуждестранни учени
|
2002
|
|
145
|
G. N. Vayssilov, N. Rösch, „Influence of Alkali and Alkaline Earth Cations on the Brønsted Acidity of Zeolites", Journal of Physical Chemistry B, том:105, 2001, стр.:4277-4284
|
2001
|
|
146
|
G. N. Vayssilov, Vayssilov, GN, Rosch, N, Influence of alkali and alkaline earth cations on the Bronsted acidity of zeolites, JOURNAL OF PHYSICAL CHEMISTRY B, vol:105, issue:19, 2001, pages:4277-4284, ISSN (print):1520-6106, ISSN (online):1520-5207, doi:10.1021/jp0041048
|
2001
|
|
147
|
G. N. Vayssilov, Theoretical Aspects of Heterogeneous Catalysis, Theoretical Aspects of Heterogeneous Catalysis, Kluwer, 2001, стр.:29-38
|
2001
|
|
148
|
G. N. Vayssilov, A. Hu, U. Birkenheuer, N. Rösch, „Dinitrogen as Probe Molecule of Alkali-Exchanged Zeolites. A Density Functional Study", Journal of Molecular Catalysis A, том:162, 2000, стр.:135-145, в сътрудничество с чуждестранни учени
|
2000
|
|
149
|
Vayssilov, GN, Hu, A, Birkenheuer, U, Rosch, N, Dinitrogen as probe molecule of alkali-exchanged zeolites - A density functional study, JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL, vol:162, issue:1-2, 2000, pages:135-145, ISSN (print):1381-1169
|
2000
|
|
150
|
Vayssilov, GN, Lercher, JA, Rosch, N, Interaction of methanol with alkali metal exchanged molecular sieves. 2. Density functional study, JOURNAL OF PHYSICAL CHEMISTRY B, vol:104, issue:35, 2000, pages:8614-8623, ISSN (print):1520-6106, ISSN (online):1520-5207, doi:10.1021/jp000195x
|
2000
|
|
151
|
G. N. Vayssilov, J. A. Lercher, N. Rösch, Interaction of Methanol with Alkali-Exchanged Molecular Sieves. II. Density Functional Study, ournal of Physical Chemistry B, том:104, 2000, стр.:8614-8623, в сътрудничество с чуждестранни учени
|
2000
|
|
152
|
J. F. Goellner, B. C. Gates, G. N. Vayssilov, N. Rösch, Structure and Bonding of a Site-Isolated Transition Metal Complex: Rhodium Dicarbonyl in Highly Dealuminated Zeolite Y, Journal of the American Chemical Society, том:122, 2000, стр.:8056-8066, в сътрудничество с чуждестранни учени
|
2000
|
|
153
|
G. N. Vayssilov, M. Staufer, K. M. Neyman, H. Knözinger, N. Rösch, "Density functional studies of alkali-exchanged zeolites. Cation location at six-rings of different aluminium content", Journal of Physical Chemistry B, том:103, 1999, стр.:7920-7928, в сътрудничество с чуждестранни учени
|
1999
|
|
154
|
G. N. Vayssilov, N. Rösch, Density functional studies of alkali-exchanged zeolites. Basicity and core level shifts of framework oxygen atoms., Journal of Catalysis, том:186, 1999, стр.:423-432, в сътрудничество с чуждестранни учени
|
1999
|
|
155
|
G. N. Vayssilov, Vayssilov, GN, Staufer, M, Belling, T, Neyman, KM, Knozinger, H, Rosch, N, Density functional studies of alkali-exchanged zeolites. Cation location at six-rings of different aluminum content, JOURNAL OF PHYSICAL CHEMISTRY B, vol:103, issue:37, 1999, pages:7920-7928, ISSN (print):1520-6106
|
1999
|
|
156
|
G. N. Vayssilov, Annuaire de l'Universite de Sofia, Annuaire de l'Universite de Sofia, том:90, 1998, стр.:195-202
|
1998
|
|
157
|
Z. Popova, G. N. Vayssilov, K. Genov, Annuaire de l'Universite de Sofia
, Annuaire de l'Universite de Sofia, том:90, 1998, стр.:221-236
|
1998
|
|
158
|
Z. Popova, G. N. Vayssilov, K. Genov, Annuaire de l'Universite de Sofia
, Annuaire de l'Universite de Sofia, том:90, 1998, стр.:221-236
|
1998
|
|
159
|
G. N. Vayssilov, Catalytic Activation and Functionalisation of Light Alkanes, Catalytic Activation and Functionalisation of Light Alkanes, 1998, стр.:439-445
|
1998
|
|
160
|
G. N. Vayssilov, R. A. van Santen, Catalytic activity of titanium silicalites - A DFT study., Journal of Catalysis, том:175, 1998, стр.:170-174
|
1998
|
|
161
|
G. N. Vayssilov, Z. Popova, A. Tuel, Catalytic Oxidation of Anisole over Titanium Silicalite-1, Chemical Engineering and Technology, том:20, 1997, стр.:333-337
|
1997
|
|
162
|
G. N. Vayssilov, Z. Popova, S. Bratinova, A. Tuel, Liquid Phase Oxidation of Alkylaromatic Hydrocarbons over Titanium Silicalites, Studies of Surface Science and Catalysis, брой:110, 1997, стр.:909-918
|
1997
|
|
163
|
G. N. Vayssilov, Structural and Physico-Chemical Features of Titanium Silicalites, Catalysis Reviews – Science and Engineering, том:39, 1997, стр.:209-251
|
1997
|
|
164
|
G. N. Vayssilov, Theoretical Models for Description of the Gas-Solid Surface Vibrational Interactions", Advances in Colloid and Interface Science, том:57, 1995, стр.:123-159
|
1995
|
|
165
|
G. N. Vayssilov, M. Yankov, Z. Popova, L. Dimitrov, Catalysis of Organic Reactions, Catalysis of Organic Reactions, 1994, стр.:493-496
|
1994
|
|
166
|
VAYSSILOV, GN, EFFECT OF VIBRATIONAL INTERACTION ON THE RATE OF DISSOCIATION OF ADSORBED MOLECULES - ETHENE ON A NICKEL SURFACE, JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS, vol:89, issue:12, 1993, pages:2049-2053, ISSN (print):0956-5000
|
1993
|
|
167
|
G. N. Vayssilov, Influence of the Solid Surface Vibrations on the Rate Constants of Surface Reactions, Advances in Colloid and Interface Science, том:43, 1993, стр.:51-85
|
1993
|
|
168
|
G. N. Vayssilov, M. Yankov, A. Hamid, Para-selective Alkylation of Toluene with Methanol over ZSM-5 Zeolites - a Kinetic Model, Applied Catalysis A, том:94, 1993, стр.:117-130
|
1993
|
|
169
|
G. N. Vayssilov, Structure and catalytic transformation of lower hydrocarbons on single-crystal surfaces of transition metals, Advances in Colloid and Interface Science, том:47, 1993, стр.:25-57
|
1993
|
|
170
|
G. N. Vayssilov, INTERACTION BETWEEN SURFACE PHONONS AND BOND VIBRATIONS OF MOLECULES ADSORBED PERPENDICULAR TO A SOLID-SURFACE, JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS, vol:88, issue:12, 1992, pages:1627-1630, ISSN (print):0956-5000
|
1992
|
|
171
|
TSEKOV, R, VAYSSILOV, G, MEMORY EFFECT ON PREEXPONENTIAL FACTOR OF RATE-CONSTANT FOR DISSOCIATION OF ADSORBED MOLECULES, JOURNAL OF PHYSICAL CHEMISTRY, vol:96, issue:8, 1992, pages:3452-3454, ISSN (print):0022-3654
|
1992
|
|
172
|
R. Tsekov, G. N. Vayssilov, Quantum Brownian Motion and Classical Diffusion, Chemical Physics Letters, том:195, 1992, стр.:423-426
|
1992
|
|
173
|
VAYSSILOV, G, TSEKOV, R, TEMPERATURE-DEPENDENCE OF THE RATE-CONSTANT FOR DISSOCIATION OF ADSORBED MOLECULES, CHEMICAL PHYSICS LETTERS, vol:188, issue:5-6, 1992, pages:497-500, ISSN (print):0009-2614
|
1992
|
|
174
|
G. N. Vayssilov, R. Tsekov, Energy Transfer in Adsorbed Molecule - Solid Surface Vibration Interactions, Surface Science, том:255, 1991, стр.:355-360, Ref, Web of Science
|
1991
|
| Статия в поредица |
|
1
|
Drenchev, Nikola L, Ivanova, Elena Z, Mihaylov, Mihail Y, Aleksandrov, Hristiyan A, Vayssilov, Georgi N, Hadjiivanov, Konstantin I, 2 Molecules., The journal of physical chemistry letters, 2023, pages:1564-1569, ISSN (online):1948-7185, doi:10.1021/acs.jpclett.2c03294
|
2023
|
|
2
|
Koleva, Iskra Z., Aleksandrov, Hristiyan A., Vayssilov, Georgi N., Comparison of the Reactivity of Platinum Cations and Clusters Supported on Ceria or Alumina in Carbon Monoxide Oxidation, ACS CATALYSIS, 2023, pages:5358-5374, ISSN (print):2155-5435, doi:10.1021/acscatal.3c01146
|
2023
|
|
3
|
Drenchev, Nikola L., Ivanova, Elena Z., Mihaylov, Mihail Y., Aleksandrov, Hristiyan A., Vayssilov, Georgi N., Hadjiivanov, Konstantin I., One Ca2+Site in CaNaY Zeolite Can Attach Three CO2 Molecules, JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2023, pages:1564-1569, ISSN (print):1948-7185, doi:10.1021/acs.jpclett.2c03294
|
2023
|
|
4
|
Khivantsev, Konstantin, Jaegers, Nicholas R., Aleksandrov, Hristiyan A., Song, Inhak, Pereira-Hernandez, Xavier Isidro, Engelhard, Mark H., Tian, Jinshu, Chen, Linxiao, Meira, Debora Motta, Kovarik, Libor, Single Ru(II) Ions on Ceria as a Highly Active Catalyst for Abatement of NO, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2023, ISSN (print):0002-7863, ISSN (online):1520-5126, doi:10.1021/jacs.2c09873
|
2023
|
|
5
|
Pique, Oriol, Koleva, Iskra Z., Bruix, Albert, Vines, Francesc, Aleksandrov, Hristiyan A. ., Vayssilov, Georgi N., Illas, Francesc, Charting the Atomic C Interaction with Transition Metal Surfaces, ACS CATALYSIS, 2022, ISSN (print):2155-5435, doi:10.1021/acscatal.2c01562
|
2022
|
|
6
|
Khivantsev, Konstantin, Kwak, Ja-Hun, Jaegers, Nicholas R., Koleva, Iskra Z., Vayssilov, Georgi N., Derewinski, Miroslaw A., Wang, Yong, Aleksandrov, Hristiyan A., Szanyi, Janos, Identification of the mechanism of NO reduction with ammonia (SCR) on zeolite catalysts, CHEMICAL SCIENCE, 2022, ISSN (print):2041-6520, ISSN (online):2041-6539, doi:10.1039/d2sc00350c
|
2022
|
|
7
|
Kolev, Stefan K., St Petkov, Petko, Milenov, Teodor, I, Vayssilov, Georgi N., Sodium and Magnesium Ion Location at the Backbone and at the Nucleobase of RNA: Ab Initio Molecular Dynamics in Water Solution, ACS OMEGA, 2022, ISSN (print):2470-1343, doi:10.1021/acsomega.2c01327
|
2022
|
|
8
|
Gramatikov, Stoyan P., St Petkov, Petko, Vayssilov, Georgi N., The relative stability of SCM-14 germanosilicate with different distributions of germanium ions in the absence and presence of structure-directing agents, INORGANIC CHEMISTRY FRONTIERS, 2022, ISSN (print):2052-1553, doi:10.1039/d2qi00697a
|
2022
|
| Статия в сборник (на конференция и др.) |
|
1
|
Vayssilov, Georgi, Aleksandrov, Hristiyan, Koleva, Iskra, Computational modeling of stability and properties of cerium dioxide supported platinum clusters and isolated platinum species, ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, vol:257, 2019, ISSN (print):0065-7727
|
2019
|
|
2
|
Roesch, Notker, Petrova, Galina P., Vayssilov, Georgi N., Shor, Elena A. Ivanova, Nasluzov, Vladimir A., Shor, Aleksey M., COMP 69-Computational study of hydrogenated transition metal clusters on zeolite support, ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, vol:235, 2008, ISSN (print):0065-7727
|
2008
|
|
3
|
Rangelov, MA, Vayssilov, GN, Petkov, DD, Quantum chemical model study of the acyl migration in 2 '(3 ')-formylnucleosides, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, vol:106, issue:6, 2006, pages:1346-1356, ISSN (print):0020-7608, ISSN (online):1097-461X, doi:10.1002/qua.20892
|
2006
|
|
4
|
G. N. Vayssilov, Roesch, N, DFT study of chemical state and structure of zeolite-supported transition metal clusters., ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, vol:227, 2004, ISSN (print):0065-7727
|
2004
|
|
5
|
G. N. Vayssilov, Theoretical modelling of propane partial oxidation over titanium silicalites, CATALYTIC ACTIVATION AND FUNCTIONALISATION OF LIGHT ALKANES, vol:44, 1998, pages:439-445, ISBN:0-7923-4960-1
|
1998
|
|
6
|
VAYSSILOV, GN, YANKOV, M, POPOVA, Z, DIMITROV, L, PARTIAL OXIDATION OF ACTIVATED AROMATICS ON MOLECULAR SIEVE CATALYSTS, CATALYSIS OF ORGANIC REACTIONS, vol:62, 1995, pages:493-496, ISBN:0-8247-9364-1
|
1995
|
| Студия в научно списание |
|
1
|
G. N. Vayssilov, Rosch, N, Nasluzov, VA, Neyman, KM, Pacchioni, G, Supported metal species and adsorption complexes on metal oxides and in zeolites: Density functional cluster model studies, COMPUTATIONAL MATERIAL SCIENCES, vol:15, 2004, pages:367-450
|
2004
|
|
2
|
G. N. Vayssilov, Vibrational interactions at the vapor-metal oxide interface, OXIDE SURFACES, vol:103, 2001, pages:411-457
|
2001
|
|
3
|
G. N. Vayssilov, STRUCTURE AND CATALYTIC TRANSFORMATIONS OF LOWER HYDROCARBONS ON SINGLE-CRYSTAL SURFACES OF TRANSITION-METALS, ADVANCES IN COLLOID AND INTERFACE SCIENCE, vol:47, 1993, pages:25-57, ISSN (print):0001-8686, ISSN (online):1873-3727
|
1993
|
|