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1Academic Journal
المؤلفون: Baumgarten, Robert, Naumann d’Alnoncourt, Raoul, Lohr, Stephen, Gioria, Esteban, Frei, Elias, Fako, Edvin, De, Sandip, Boscagli, Chiara, Drieß, Matthias, Schunk, Stephan, Rosowski, Frank
مصطلحات موضوعية: CO2, Hydrogenation, Indium oxide, Methanol, N2O reactive frontal chromatography, info:eu-repo/classification/ddc/660, ddc:660
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2Dissertation/ Thesis
المؤلفون: Fako, Edvin
المساهمون: University/Department: Universitat Rovira i Virgili. Departament de Química Física i Inorgànica
Thesis Advisors: López Alonso, Núria
المصدر: TDX (Tesis Doctorals en Xarxa)
مصطلحات موضوعية: Catàlisi heterogènia, Catàlisi d’un àtom únic, DFT, Catálisis heterogénea, Catálisis de átomo único, Heterogenous Catalysis, Single Atom Catalysis, Ciències
وصف الملف: application/pdf
URL الوصول: http://hdl.handle.net/10803/671189
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3Report
المؤلفون: Batatia, Ilyes, Benner, Philipp, Chiang, Yuan, Elena, Alin M., Kovács, Dávid P., Riebesell, Janosh, Advincula, Xavier R., Asta, Mark, Avaylon, Matthew, Baldwin, William J., Berger, Fabian, Bernstein, Noam, Bhowmik, Arghya, Blau, Samuel M., Cărare, Vlad, Darby, James P., De, Sandip, Della Pia, Flaviano, Deringer, Volker L., Elijošius, Rokas, El-Machachi, Zakariya, Falcioni, Fabio, Fako, Edvin, Ferrari, Andrea C., Genreith-Schriever, Annalena, George, Janine, Goodall, Rhys E. A., Grey, Clare P., Grigorev, Petr, Han, Shuang, Handley, Will, Heenen, Hendrik H., Hermansson, Kersti, Holm, Christian, Jaafar, Jad, Hofmann, Stephan, Jakob, Konstantin S., Jung, Hyunwook, Kapil, Venkat, Kaplan, Aaron D., Karimitari, Nima, Kermode, James R., Kroupa, Namu, Kullgren, Jolla, Kuner, Matthew C., Kuryla, Domantas, Liepuoniute, Guoda, Margraf, Johannes T., Magdău, Ioan-Bogdan, Michaelides, Angelos, Moore, J. Harry, Naik, Aakash A., Niblett, Samuel P., Norwood, Sam Walton, O'Neill, Niamh, Ortner, Christoph, Persson, Kristin A., Reuter, Karsten, Rosen, Andrew S., Schaaf, Lars L., Schran, Christoph, Shi, Benjamin X., Sivonxay, Eric, Stenczel, Tamás K., Svahn, Viktor, Sutton, Christopher, Swinburne, Thomas D., Tilly, Jules, van der Oord, Cas, Varga-Umbrich, Eszter, Vegge, Tejs, Vondrák, Martin, Wang, Yangshuai, Witt, William C., Zills, Fabian, Csányi, Gábor
مصطلحات موضوعية: Physics - Chemical Physics, Condensed Matter - Materials Science
URL الوصول: http://arxiv.org/abs/2401.00096
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4Report
المؤلفون: Schaaf, Lars, Fako, Edvin, De, Sandip, Schäfer, Ansgar, Csányi, Gábor
مصطلحات موضوعية: Physics - Chemical Physics, Physics - Computational Physics
URL الوصول: http://arxiv.org/abs/2301.09931
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5Academic Journal
المؤلفون: Hursán, Dorottya, Ábel, Marietta, Baán, Kornélia, Fako, Edvin, Samu, Gergely, Nguyën, Huu, López, Núria, Kónya, Zoltán, Sápi, András, Janáky, Csaba, Atanassov, Plamen
المصدر: ACS Catalysis. 12(16)
وصف الملف: application/pdf
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6Academic Journal
المؤلفون: Neyyathala, Arjun, Fako, Edvin, De, Sandip, Gashnikova, Daria, Maurer, Florian, Grunwaldt, Jan-Dierk, Schunk, Stephan A., Hanf, Schirin
المصدر: Small Structures, 6 (1), 2400260 ; ISSN: 2688-4062
مصطلحات موضوعية: ddc:540, Chemistry & allied sciences, info:eu-repo/classification/ddc/540
وصف الملف: application/pdf
Relation: info:eu-repo/semantics/altIdentifier/wos/001365215700001; info:eu-repo/semantics/altIdentifier/issn/2688-4062; https://publikationen.bibliothek.kit.edu/1000177023; https://publikationen.bibliothek.kit.edu/1000177023/155898383; https://doi.org/10.5445/IR/1000177023
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7Report
المؤلفون: Fako, Edvin, Dobrota, Ana S., Pašti, Igor A., López, Núria, Mentus, Slavko V., Skorodumova, Natalia V.
المصدر: Phys. Chem. Chem. Phys., 2018, 20, 1524-1530
مصطلحات موضوعية: Condensed Matter - Materials Science
URL الوصول: http://arxiv.org/abs/1710.09996
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8Academic Journal
المؤلفون: Khatamirad, Mohammad, Fako, Edvin, De, Sandip, Müller, Matthias, Boscagli, Chiara, Baumgarten, Robert, Ingale, Piyush, d'Alnoncourt, Raoul Naumann, Rosowski, Frank, Schunk, Stephan Andreas
مصطلحات موضوعية: 500 Naturwissenschaften und Mathematik::540 Chemie::540 Chemie und zugeordnete Wissenschaften, data-driven, high-throughput, accelerated design, CO2 hydrogenation
وصف الملف: application/pdf
Relation: https://depositonce.tu-berlin.de/handle/11303/19952; https://doi.org/10.14279/depositonce-18750
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9Academic Journal
المؤلفون: Khatamirad, Mohammad, Fako, Edvin, Boscagli, Chiara, Müller, Matthias, Ebert, Fabian, Naumann d'Alnoncourt, Raoul, Schaefer, Ansgar, Schunk, Stephan Andreas, Jevtovikj, Ivana, Rosowski, Frank, De, Sandip
مصطلحات موضوعية: 500 Naturwissenschaften und Mathematik::540 Chemie::540 Chemie und zugeordnete Wissenschaften, catalysts, CO2 hydrogenation, methanol, high-throughput workflow, CO2 to methanol reaction
وصف الملف: application/pdf
Relation: https://depositonce.tu-berlin.de/handle/11303/19104; https://doi.org/10.14279/depositonce-17901
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10Academic Journal
المؤلفون: Khatamirad, Mohammad, Fako, Edvin, De, Sandip, Müller, Matthias, Boscagli, Chiara, Baumgarten, Robert, Ingale, Piyush, d'Alnoncourt, Raoul Naumann, Rosowski, Frank, Schunk, Stephan Andreas
المساهمون: Deutsche Forschungsgemeinschaft
المصدر: ChemCatChem ; volume 15, issue 16 ; ISSN 1867-3880 1867-3899
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11Academic Journal
المؤلفون: Schaaf, Lars L., Fako, Edvin, De, Sandip, Schäfer, Ansgar, Csányi, Gábor
المساهمون: RCUK | Engineering and Physical Sciences Research Council, BASF
المصدر: npj Computational Materials ; volume 9, issue 1 ; ISSN 2057-3960
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12Academic Journal
المؤلفون: Khatamirad, Mohammad, Fako, Edvin, Boscagli, Chiara, Müller, Matthias, Ebert, Fabian, Naumann d'Alnoncourt, Raoul, Schaefer, Ansgar, Schunk, Stephan Andreas, Jevtovikj, Ivana, Rosowski, Frank, De, Sandip
المساهمون: Deutsche Forschungsgemeinschaft
المصدر: Catalysis Science & Technology ; volume 13, issue 9, page 2656-2661 ; ISSN 2044-4753 2044-4761
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13Academic Journal
المؤلفون: Hursán Dorottya, Ábel Marietta, Baán Kornélia, Fako Edvin, Samu Gergely Ferenc, Huu Chuong Nguyën, López Núria, Atanassov Plamen, Kónya Zoltán, Sápi András, Janáky Csaba
مصطلحات موضوعية: 01.04. Kémiai tudományok
وصف الملف: text
Relation: http://publicatio.bibl.u-szeged.hu/25040/1/CO2ConversiononN-DopedCarbonCatalystsviaThermo-andElectrocatalysis-RoleofCNOxMoieties.pdf; Hursán Dorottya; Ábel Marietta; Baán Kornélia; Fako Edvin; Samu Gergely Ferenc; Huu Chuong Nguyën; López Núria; Atanassov Plamen; Kónya Zoltán; Sápi András; Janáky Csaba: CO 2 Conversion on N-Doped Carbon Catalysts via Thermo- and Electrocatalysis: Role of C–NO x Moieties. ACS CATALYSIS, 12 (16). pp. 10127-10140. ISSN 2155-5435 (2022)
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14Academic Journal
المؤلفون: Baumgarten, Robert, Naumann d'Alnoncourt, Raoul, Lohr, Stephen, Gioria, Esteban, Frei, Elias, Fako, Edvin, De, Sandip, Boscagli, Chiara, Drieß, Matthias, Schunk, Stephan, Rosowski, Frank
المساهمون: Deutsche Forschungsgemeinschaft
المصدر: Chemie Ingenieur Technik ; volume 94, issue 11, page 1765-1775 ; ISSN 0009-286X 1522-2640
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15
المؤلفون: Gutic, Sanjin J., Dobrota, Ana S., Fako, Edvin, Skorodumova, Natalia V., Lopez, Nuria, Pasti, Igor A.
المصدر: Catalysts. 10(3)
مصطلحات موضوعية: hydrogen evolution reaction, catalysis, supported catalysts, single atom catalysts
وصف الملف: electronic
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16Academic Journal
المؤلفون: Faust Akl, Dario, id_orcid:0 000-0001-5317-4950, Ruiz-Ferrando, Andrea, Fako, Edvin, Hauert, Roland, Safonova, Olga V., Mitchell, Sharon, López, Núria, Pérez-Ramírez, Javier
المصدر: ChemCatChem, 13 (14)
مصطلحات موضوعية: Alkyne hydrogenation, Iron catalysts, Nuclearity effects, Single atoms, Carbon nitride
وصف الملف: application/application/pdf
Relation: info:eu-repo/semantics/altIdentifier/wos/000654746600001; http://hdl.handle.net/20.500.11850/493460
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17Academic Journal
المؤلفون: Faust Akl, Dario, Ruiz‐Ferrando, Andrea, Fako, Edvin, Hauert, Roland, Safonova, Olga, Mitchell, Sharon, López, Núria, Pérez‐Ramírez, Javier
المصدر: ChemCatChem ; volume 13, issue 14, page 3199-3199 ; ISSN 1867-3880 1867-3899
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18
المؤلفون: Gupta, Srishti, Rajan, Ajin, Fako, Edvin, Goncalves, Tiago, Mueller, Imke, Varghese, Jithin John, Schaefer, Ansgar, De, Sandip
الاتاحة: https://doi.org/10.26434/chemrxiv-2024-34mq8-v2
https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/675ff2a281d2151a02ee38e7/original/exploring-the-intricacies-of-glycerol-hydrodeoxygenation-to-propanediol-on-cu-surface-a-comprehensive-investigation-with-the-aid-of-machine-learning-forcefield.pdf -
19
المؤلفون: Neyyathala, Arjun, Fako, Edvin, De, Sandip, Gashnikova, Daria, Maurer, Florian, Grunwaldt, Jan-Dierk, Schunk, Stephan Andreas, Hanf, Schirin
Relation: https://doi.org/10.5281/zenodo.11082359; https://doi.org/10.5281/zenodo.11082360; oai:zenodo.org:11082360
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20
المؤلفون: Gupta, Srishti, Rajan, Ajin, Fako, Edvin, Goncalves, Tiago, Mueller, Imke, Varghese, Jithin John, De, Sandip
الاتاحة: https://doi.org/10.26434/chemrxiv-2024-34mq8
https://chemrxiv.org/engage/api-gateway/chemrxiv/assets/orp/resource/item/6616cefd21291e5d1d8cf07d/original/exploring-the-intricacies-of-glycerol-hydrodeoxygenation-to-propanediol-on-cu-catalysts-a-comprehensive-investigation-with-the-aid-of-machine-learning-forcefield.pdf