20002020

Research output per year

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Research Output

DFT simulation of the X-ray diffraction pattern of aluminum-ion-intercalated graphite used as the cathode material of the aluminum-ion battery

Li, J., Liu, Q., Flores, R. A., Lemmon, J. & Bligaard, T., 2020, In : Physical Chemistry Chemical Physics. 22, 10, p. 5969-5975

Research output: Contribution to journalJournal articleResearchpeer-review

The Materials Research Platform: Defining the Requirements from User Stories

Aykol, M., Hummelshøj, J. S., Anapolsky, A., Aoyagi, K., Bazant, M. Z., Bligaard, T., Braatz, R. D., Broderick, S., Cogswell, D., Dagdelen, J., Drisdell, W., Garcia, E., Garikipati, K., Gavini, V., Gent, W. E., Giordano, L., Gomes, C. P., Gomez-Bombarelli, R., Balaji Gopal, C., Gregoire, J. M. & 24 others, Grossman, J. C., Herring, P., Hung, L., Jaramillo, T. F., King, L., Kwon, H. K., Maekawa, R., Minor, A. M., Montoya, J. H., Mueller, T., Ophus, C., Rajan, K., Ramprasad, R., Rohr, B., Schweigert, D., Shao-Horn, Y., Suga, Y., Suram, S. K., Viswanathan, V., Whitacre, J. F., Willard, A. P., Wodo, O., Wolverton, C. & Storey, B. D., 2019, In : Matter. 1, 6, p. 1433-1438

Research output: Contribution to journalComment/debateResearchpeer-review

Bottom-Up Design of a Copper-Ruthenium Nanoparticulate Catalyst for Low-Temperature Ammonia Oxidation

Chakraborty, D., Damsgaard, C. D., Silva, H. J. L., Conradsen, C. N., Olsen, J. L., de Carvalho, H. W. P., Mutz, B., Bligaard, T., Hoffmann, M. J., Grunwaldt, J-D., Studt, F. & Chorkendorff, I., 2017, In : Angewandte Chemie International Edition. 56, 30, p. 8711-8715 6 p.

Research output: Contribution to journalJournal articleResearchpeer-review

Genetic Algorithm Procreation Operators for Alloy Nanoparticle Catalysts

Lysgaard, S., Landis, D. D., Bligaard, T. & Vegge, T., 2014, In : Topics in Catalysis. 57, 1-4, p. 33-39

Research output: Contribution to journalJournal articleResearchpeer-review

The Influence of Particle Shape and Size on the Activity of Platinum Nanoparticles for Oxygen Reduction Reaction: A Density Functional Theory Study

Tripkovic, V., Cerri, I., Bligaard, T. & Rossmeisl, J., 2014, In : Catalysis Letters. 144, 3, p. 380-388

Research output: Contribution to journalJournal articleResearchpeer-review

Projects