Engineering and Physical Sciences Research Council (Grant No. EP/L000202/1; EP/P020232/1)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Loizidou, Eriketi Z. and Chutia, Arunabhiram (2019) Size-dependent bond dissociation enthalpies in single-walled carbon nanotubes. Chemical Physics Letters, 731:136628. ISSN 0009-2614 (doi:10.1016/j.cplett.2019.136628)

Engineering and Physical Sciences Research Council (Grant No. EP/L02537X/1; EP/L026317/1)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 and Catlow, C. Richard A. (2019) An experimental and computational IR and hybrid DFT-D3 study of the conformations of L-lactic and acrylic acid: new insight to the dehydration mechanism of lactic acid to acrylic acid. Physical Chemistry Chemical Physics, 21 (40). pp. 22331-22343. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/C9CP02968K)

Engineering and Physical Sciences Research Council (Grant No. EP/L026317/1; EP/K014714/1; EP/L000202/1)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 (2019) Mechanisms of ammonia and hydrazine synthesis on η-Mn3N2-(100) surfaces. Physical Chemistry Chemical Physics, 21 (35). pp. 19365-19377. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/C9CP03934A)

Engineering and Physical Sciences Research Council (Grant No. EP/L026317/1; EP/L02537X/1; EP/L000202/1)

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Bion, Nicholas, Catlow, Richard Charles Arthur and Hargreaves, Justin (2020) Combination of theoretical and in-situ experimental investigations of the role of lithium dopant in manganese nitride: a two-stage reagent for ammonia synthesis. Faraday Discussions, 229. pp. 281-296. ISSN 1359-6640 (Print), 1364-5498 (Online) (doi:10.1039/C9FD00131J)

Engineering and Physical Sciences Research Council (Grant Nos. EP/L02537X/1 and EP/L026317/1)

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Catlow, C. Richard A. and Hargreaves, Justin S. J. (2017) The potential of manganese nitride based materials as nitrogen transfer reagents for nitrogen chemical looping. Applied Catalysis B: Environmental, 223. pp. 60-66. ISSN 0926-3373 (doi:10.1016/j.apcatb.2017.04.073)

Engineering and Physical Sciences Research Council (Grant Nos. EP/L02537X/1, EP/L000202/1)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 and Catlow, C. Richard A. (2017) A computational study of the heterogeneous synthesis of hydrazine on Co3Mo3N. Catalysis Letters, 147 (7). pp. 1820-1826. ISSN 1011-372X (doi:10.1007/s10562-017-2080-y)

European Committee (6th FP, Grant No. 5183309 (SES6))

Olympiou, George G., Kalamaras, Christos M., Zeinalipour-Yazdi, Constantinos ORCID: https://orcid.org/0000-0002-8388-1549 and Efstathiou, Angelos M. (2007) Mechanistic aspects of the water-gas shift reaction on alumina-supported noble metal catalysts: In situ DRIFTS and SSITKA-mass spectrometry studies. Catalysis Today, 127 (1-4). pp. 304-318. ISSN 0920-5861 (doi:10.1016/j.cattod.2007.05.002)

Hauts-de-France

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Bion, Nicholas, Catlow, Richard Charles Arthur and Hargreaves, Justin (2020) Combination of theoretical and in-situ experimental investigations of the role of lithium dopant in manganese nitride: a two-stage reagent for ammonia synthesis. Faraday Discussions, 229. pp. 281-296. ISSN 1359-6640 (Print), 1364-5498 (Online) (doi:10.1039/C9FD00131J)

Make Our Planet Great Again

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Bion, Nicholas, Catlow, Richard Charles Arthur and Hargreaves, Justin (2020) Combination of theoretical and in-situ experimental investigations of the role of lithium dopant in manganese nitride: a two-stage reagent for ammonia synthesis. Faraday Discussions, 229. pp. 281-296. ISSN 1359-6640 (Print), 1364-5498 (Online) (doi:10.1039/C9FD00131J)

PRESTIGE H2020 program

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Bion, Nicholas, Catlow, Richard Charles Arthur and Hargreaves, Justin (2020) Combination of theoretical and in-situ experimental investigations of the role of lithium dopant in manganese nitride: a two-stage reagent for ammonia synthesis. Faraday Discussions, 229. pp. 281-296. ISSN 1359-6640 (Print), 1364-5498 (Online) (doi:10.1039/C9FD00131J)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement No. EP/L026317/1

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 and Loizidou, Eriketi Z. (2017) Study of the cap structure of (3, 3),(4, 4) and (5, 5)-SWCNTs: Application of the sphere-in-contact model. Carbon, 115. pp. 819-827. ISSN 0008-6223 (doi:10.1016/j.carbon.2017.01.074)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 (2016) DFT study of the coverage-dependent chemisorption of molecular H2 on neutral cobalt dimers. Surface Science, 656. pp. 54-59. ISSN 0039-6028 (doi:10.1016/j.susc.2016.10.003)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Hargreaves, Justin S. J. and Catlow, C. Richard A. (2015) Nitrogen activation in a Mars-van Krevelen mechanism for ammonia synthesis on Co3Mo3N. The Journal of Physical Chemistry C, 119 (51). pp. 28368-28376. ISSN 1932-7447 (Print), 1932-7455 (Online) (doi:10.1021/acs.jpcc.5b06811)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/E046754/1; EP/G007594/3

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Willock, David J., Machado, Andreia, Wilson, Karen and Lee, Adam F. (2013) Impact of co-adsorbed oxygen on crotonaldehyde adsorption over gold nanoclusters: a computational study. Physical Chemistry Chemical Physics, 2014 (23):16. pp. 11202-11210. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/c3cp53691b)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/K014706/1, EP/K014668/1, EP/K014854/1, EP/K014714/1, EP/I019693/1, EP/P020232/1

Dann, Ellie K., Gibson, Emma K., Blackmore, Rachel H., Catlow, C. Richard A., Collier, Paul, Chutia, Arunabhiram, Eralp Erden, Tugce, Hadacare, Christopher, Kroner, Anna, Nachtegaal, Martin, Raj, Agnes, Rogers, Scott M., Taylor, S. F. Rebecca, Thompson, Paul, Tierney, George F., Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Goguet, Alexandre and Wells, Peter P. (2019) Structural selectivity of supported Pd nanoparticles for catalytic NH3 oxidation resolved using combined operando spectroscopy. Nature Catalysis, 2. pp. 157-163. ISSN 2520-1158 (Online) (doi:10.1038/s41929-018-0213-3)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/L02537X/1, EP/L026317/1

Laassiri, Said, Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Catlow, C. Richard A. and Hargreaves, Justin S. J. (2016) Nitrogen transfer properties in tantalum nitride based materials. Catalysis Today, 286. pp. 147-154. ISSN 0920-5861 (doi:10.1016/j.cattod.2016.06.035)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/L02537X/1, EP/L026317/1, EP/K014714/1

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Hargreaves, Justin S. J., Laassiri, Said and Catlow, C. Richard A. (2018) The integration of experiment and computational modelling in heterogeneously catalysed ammonia synthesis over metal nitrides. Physical Chemistry Chemical Physics, 20 (34). pp. 21803-21808. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/C8CP04216K)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/L026317/1, EP/K014714/1

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549 (2018) On the possibility of an Eley-Rideal mechanism for ammonia synthesis on Mn6N5+x (x=1)-(111) surfaces. Physical Chemistry Chemical Physics, 20 (27). pp. 18729-18736. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/C8CP02381F)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/L026317/1, EP/L02537X/1

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Hargreaves, Justin S. J., Laassiri, Said and Catlow, C. Richard A. (2017) DFT-D3 study of H 2 and N 2 chemisorption over cobalt promoted Ta 3 N 5-(100), (010) and (001) surfaces. Physical Chemistry Chemical Physics, 2017 (19). pp. 11968-11974. ISSN 1463-9076 (Print), 1463-9084 (Online) (doi:10.1039/C7CP00806F)

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Hargreaves, Justin S. J. and Catlow, C. Richard A. (2016) DFT-D3 study of molecular N2 and H2 activation on Co3Mo3N surfaces. The Journal of Physical Chemistry C, 120 (38). pp. 21390-21398. ISSN 1932-7447 (Print), 1932-7447 (Online) (doi:10.1021/acs.jpcc.6b04748)

The Engineering and Physical Sciences Research Council (EPSRC); Grant Agreement Nos. EP/L026317/1; EP/L02537X/1

Zeinalipour-Yazdi, Constantinos D. ORCID: https://orcid.org/0000-0002-8388-1549, Hargreaves, Justin S. J. and Catlow, C. Richard A. (2018) Low-T mechanisms of ammonia synthesis on Co3Mo3N. The Journal of Physical Chemistry C, 122 (11). pp. 6078-6082. ISSN 1932-7447 (Print), 1932-7455 (Online) (doi:10.1021/acs.jpcc.7b12364)