David Holec

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Research output

  1. 2025
  2. Published

    Metastable AlB2 structured TM-Si-B2±z (TM = Ti, Zr, Hf) solid solutions from first-principles

    Gutschka, C., Zauner, L., Glechner, T., Holec, D. & Riedl, H., 4 Mar 2025, In: Acta materialia. 289.2025, 1 May, 12 p.

    Research output: Contribution to journal › Article › Research › peer-review

  3. Published

    Effect of tramp elements on the microstructural evolution of a ferritic-pearlitic steel

    Hatzenbichler, L., Vincely, C., Haslberger, P., Galler, M., Glushko, O., Holec, D., Clemens, H. & Schnitzer, R., 21 Feb 2025, In: Practical metallography = Praktische Metallographie. 62.2025, 3, p. 148-175 28 p.

    Research output: Contribution to journal › Article › Research

  4. Published

    Harvesting superior intrinsic plasticity in nitride ceramics with negative stacking fault energy

    Huang, Y., Chen, Z., Meindlhumer, M., Hahn, R., Holec, D., Leiner, T., Maier-Kiener, V., Zheng, Y., Zhang, Z., Hatzenbichler, L., Riedl, H., Mitterer, C. & Zhang, Z., 23 Jan 2025, In: Acta Materialia. 286.2025, 1 March, 15 p., 120774.

    Research output: Contribution to journal › Article › Research › peer-review

  5. Published

    Accurate prediction of structural and mechanical properties on amorphous materials enabled through machine-learning potentials: A case study of silicon nitride

    Nayak, G. K., Srinivasan, P., Todt, J., Daniel, R., Nicolini, P. & Holec, D., 6 Jan 2025, In: Computational materials science. 249.2025, 5 February, 11 p., 113629.

    Research output: Contribution to journal › Article › Research › peer-review

  6. 2024
  7. Published

    Magnetic moments in CrN-based systems are robust: An ab initio study of alloys and superlattices

    Matas, M., Mayrhofer, P. H. & Holec, D., 23 Nov 2024, In: Surface & coatings technology. 496.2025, 15 January, 8 p., 131540.

    Research output: Contribution to journal › Article › Research › peer-review

  8. Published

    Hydrogen penetration into the NiTi superelastic alloy investigated in-situ by synchrotron diffraction experiments

    Weiser, A., Todt, J., Holcova, J., Zalezak, T., Paulik, A., Holec, D., Jary, M., Zobac, O., Mrazek, J., Frenzel, J., Keckes, J. & Dlouhý, A., 23 Jul 2024, In: Acta materialia. 277.2024, 15 September, 11 p., 120217.

    Research output: Contribution to journal › Article › Research › peer-review

  9. Published

    Possible charge ordering and anomalous transport in graphene/graphene quantum dot heterostructure

    Roy, R., Holec, D., Michal, L., Hemzal, D., Sarkar, S., Kumar, G. S., Nečas, D., Dhankhar, M., Kaushik, P., Gómez, I. J. & Zajíčková, L., 3 Jul 2024, In: Journal of physics (Condensed matter). 2024, 36, 12 p., 265601.

    Research output: Contribution to journal › Article › Research › peer-review

  10. Published

    Ab initio study of oxygen vacancy filament formation at Ta/HfO2 interface

    Zhang, D., Wang, J., Wu, Q., Du, Y. & Holec, D., Jun 2024, In: Surfaces and Interfaces. 49.2024, June, 11 p., 104418.

    Research output: Contribution to journal › Article › Research › peer-review

  11. E-pub ahead of print

    Nanocomposite versus solid solution formation in the TiSiN system

    Schalk, N., Moritz, Y., Nayak, G. K., Holec, D., Hugenschmidt, C., Burwitz, V. V., Mathes, L., Schiester, M., Saringer, C., Czettl, C., Pohler, M., Mitterer, C. & Tkadletz, M., 30 May 2024, (E-pub ahead of print) In: Acta materialia. 275.2024, 15 August, 10 p., 120063.

    Research output: Contribution to journal › Article › Research › peer-review

  12. Published

    Interplay between alloying and tramp element effects on temper embrittlement in bcc iron: DFT and thermodynamic insights

    Reiners-Sakic, A., Schnitzer, R. & Holec, D., 27 May 2024, In: Acta materialia. 275.2024, 15 August, 12 p., 120044.

    Research output: Contribution to journal › Article › Research › peer-review

  13. Published

    Predictive Model for Catalytic Methane Pyrolysis

    Pototschnig, U., Matas, M., Scheiblehner, D., Neuschitzer, D., Obenaus-Emler, R., Antrekowitsch, H. & Holec, D., 25 May 2024, In: Journal of physical chemistry C (C, Nanomaterials and interfaces). 128.2024, 22, p. 9034-9040 7 p.

    Research output: Contribution to journal › Article › Research › peer-review

  14. Published

    Effect of Nb incorporation in Mo2BC coatings on structural and mechanical properties—Ab initio modelling and experiment

    Zenisek, J., Soucek, P., Ondračka, P., Czigány, Z., Buršíková, V., Holec, D., Balazsi, K. & Vasina, P., 15 Apr 2024, In: Acta materialia. 268.2024, 15 April, 12 p., 119741.

    Research output: Contribution to journal › Article › Research › peer-review

  15. Published

    Structure–Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys

    Friák, M., Cipek, P., Pavlu, J., Zobac, O., Roupcova, P., Miháliková, I., Holec, D., Msallamova, S. & Michalcova, A., 4 Apr 2024, In: Metallurgical and materials transactions. A, Physical metallurgy and materials science . 55.2024, June, p. 1867-1877 11 p.

    Research output: Contribution to journal › Article › Research › peer-review

  16. Published

    Elucidating effects of Eu and P on solidification and precipitation of Al-7Si-0.3Mg based alloys refined by Ta and TiB2

    Spáčil, I., Gehringer, D., Holec, D., Albu, M. & LI, J., 25 Mar 2024, In: Journal of alloys and compounds. 978.2024, 25 March, 16 p., 173343.

    Research output: Contribution to journal › Article › Research › peer-review

  17. Published

    A model for catalytic methane pyrolysis - A DFT study

    Matas, M., Pototschnig, U. & Holec, D., 2024.

    Research output: Contribution to conference › Poster › Research › peer-review

  18. Published

    Influence of Sc, Y, Ti, Zr, Hf, V, Nb, and Ta on structural and mechanical properties of Cr-Al-N coatings

    Mayrhofer, P., Zhou, L. & Holec, D., 2024, In: Berg- und hüttenmännische Monatshefte : BHM. 169.2024, 7, p. 375-380 6 p.

    Research output: Contribution to journal › Article › Research

  19. 2023
  20. E-pub ahead of print

    W18O49 Nanowhiskers Decorating SiO2 Nanofibers: Lessons from in situ SEM/TEM growth to large scale synthesis and fundamental structural understanding

    Kundrat, V., Bukvisova, K., Novak, L., Prucha, L., Houben, L., Zalesak, J., Vukusic, A., Holec, D., Tenne, R. & Pinkas, J., 5 Dec 2023, (E-pub ahead of print) In: Crystal growth & design. 24.2024, 1, p. 378-390 13 p.

    Research output: Contribution to journal › Article › Research › peer-review

  21. Published

    sqsgenerator

    Holec, D. (Producer), Gehringer, D. (Producer) & Friák, M. (Producer), 21 Nov 2023

    Research output: Non-textual form › Software › Transfer

  22. Published

    Revealing effects of solute Ta on solidification and precipitation of Al-7Si-0.3Mg based alloys

    Spacil, I., Holec, D., Albu, M. & LI, J., Aug 2023, In: Materialia. 30.2023, August, 17 p., 101846.

    Research output: Contribution to journal › Article › Research › peer-review

  23. E-pub ahead of print

    On energetics of allotrope transformations in transition-metal diborides via plane-by-plane shearing

    Leiner, T., Koutná, N., Janovec, J., Zelený, M., Mayrhofer, P. H. & Holec, D., 29 Jun 2023, (E-pub ahead of print) In: Vacuum. 215.2023, September, 9 p., 112329.

    Research output: Contribution to journal › Article › Research › peer-review

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