Researcher Portfolio

Garcia-Vergniory, Maia

Inorganic Chemistry, Max Planck Institute for Chemical Physics of Solids, Max Planck Society

Researcher Profile

Position: Inorganic Chemistry, Max Planck Institute for Chemical Physics of Solids, Max Planck Society

Researcher ID: https://pure.mpg.de/cone/persons/resource/persons268486

External references

WorldCat Search for Garcia-Vergniory, Maia

Google Scholar Search for Garcia-Vergniory, Maia

Publications

(1 - 25 of 303)

Prev1234567Next

: Rao, Z., Ponge, D., Körmann, F., Ikeda, Y., Schneeweiss, O., Friák, M., Neugebauer, J., Raabe, D., & Li, Z. (2019). Invar effects in FeNiCo medium entropy alloys: From an Invar treasure map to alloy design. Intermetallics, 111: 106520. doi:10.1016/j.intermet.2019.106520. [PubMan] : Friák, M., Buršíková, V., Pizúrová, N., Pavlů, J., Jirásková, Y., Homola, V., Miháliková, I., Slávik, A., Holec, D., Všianská, M., Koutná, N., Fikar, J., Janičkovič, D., Šob, M., & Neugebauer, J. (2019). Elasticity of phases in Fe–Al–Ti superalloys: Impact of atomic order and anti-phase boundaries. Crystals, 9(6): 299. doi:10.3390/cryst9060299. [PubMan] : Rao, Z., Ponge, D., Körmann, F., Ikeda, Y., Schneeweiss, O., Friák, M., Neugebauer, J., Raabe, D., & Li, Z. (2019). Invar effects in FeNiCo medium entropy alloys: from an invar treasure map to alloy design. Poster presented at DPG Regensburg 2019, Regensburg, Germany. [PubMan] : Roters, F., Diehl, M., Shanthraj, P., Eisenlohr, P., Reuber, J. C., Wong, S. L., Maiti, T., Ebrahimi, A., Hochrainer, T., Fabritius, H.-O., Nikolov, S. D., Friák, M., Fujita, N., Grilli, N., Janssens, K. G., Jia, N., Kok, P., Ma, D., Meier, F., Werner, E., Stricker, M., Weygand, D. M., & Raabe, D. (2019). DAMASK – The Düsseldorf Advanced Material Simulation Kit for modeling multi-physics crystal plasticity, thermal, and damage phenomena from the single crystal up to the component scale. Computational Materials Science, 158, 420-478. doi:10.1016/j.commatsci.2018.04.030. [PubMan] : Friák, M., Slávik, A., Miháliková, I., Holec, D., Všianská, M., Šob, M., Palm, M., & Neugebauer, J. (2018). Origin of the Low Magnetic Moment in Fe₂AlTi: An Ab Initio Study. Materials, 11(9): 1732. doi:10.3390/ma11091732. [PubMan] : Friák, M., Holec, D., Jirásková, Y., Palm, M., Stein, F., Janičkovič, D., Pizúrová, N., Dymáček, P., Dobeš, F., Šesták, P., Fikar, J., Šremr, J., Boutur, D., Nechvátal, L., Pavlů, J., Oweisová, S., Homola, V., Titov, A., Miháliková, I., Slávik, A., Buršíková, V., Neugebauer, J., & Šob, M. (2017). Theory-guided Design of Novel Fe–Al-based Superalloys. Talk presented at Intermetallics 2017, Educational Center Kloster Banz. Bad Staffelstein, Germany. 2017-10-02 - 2017-10-06. [PubMan] : Friák, M., Holec, D., Jirásková, Y., Palm, M., Stein, F., Janičkovič, D., Pizúrová, N., Dymáček, P., Dobeš, F., Šesták, P., Fikar, J., Šremr, J., Nechvátal, L., Oweisová, S., Homola, V., Titov, A., Slávik, A., Miháliková, I., Pavlů, J., Buršíková, V., Neugebauer, J., Boutur, D., Lapusta, Y., & Šob, M. (2017). Theory-guided Design of Novel Fe–Al-based Superalloys. In M. Heilmaier, M. Krüger, S. Mayer, M. Palm, & F. Stein (Eds.), Proc. Intermetallics 2017 (pp. 123-125). Jena, Germany: Conventus Congressmanagement & Marketing GmbH. [PubMan] : Sandlöbes, S., Friák, M., Korte-Kerzel, S., Pei, Z., Neugebauer, J., & Raabe, D. (2017). A rare-earth free magnesium alloy with improved intrinsic ductility. Scientific Reports, 7: 10458. doi:10.1038/s41598-017-10384-0. [PubMan] : Dey, P., Yao, M., Friák, M., Hickel, T., Raabe, D., & Neugebauer, J. (2017). Ab-initio investigation of the role of kappa carbide in upgrading Fe–Mn–Al–C alloy to the class of advanced high-strength steels. Talk presented at ArcelorMittal Global R&D Gent. Thessaloniki, Greece. 2017-09-17 - 2017-09-22. [PubMan] : Schneeweiss, O., Friák, M., Dudová, M., Holec, D., Šob, M., Kriegner, D., Holý, V., Beran, P., George, E. P., Neugebauer, J., & Dlouhý, A. (2017). Magnetic properties of the CrMnFeCoNi high-entropy alloy. Physical Review B, 96(1): 014437. doi:10.1103/PhysRevB.96.014437. [PubMan] : Holec, D., Zhou, L., Riedl, H., Koller, C. M., Mayrhofer, P. H., Friák, M., Šob, M., Körmann, F., Neugebauer, J., Mušić, D., Hartmann, M. A., & Fischer, F. D. (2017). Atomistic Modeling-Based Design of Novel Materials. Advanced Engineering Materials, 19(4): 1600688. doi:10.1002/adem.201600688. [PubMan] : Dey, P., Nazarov, R., Dutta, B., Yao, M., Herbig, M., Friák, M., Hickel, T., Raabe, D., & Neugebauer, J. (2017). Ab initio explanation of disorder and off-stoichiometry in Fe–Mn–Al–C κ carbides. Physical Review B, 95: 104108. doi:10.1103/PhysRevB.95.104108. [PubMan] : Pei, Z., Zhang, X., Hickel, T., Friák, M., Sandlöbes, S., Dutta, B., & Neugebauer, J. (2017). Atomic structures of twin boundaries in hexagonal close-packed metallic crystals with particular focus on Mg. npj Computational Materials, 3: 6, pp. 1-7. doi:10.1038/s41524-017-0010-6. [PubMan] : Dey, P., Nazarov, R., Dutta, B., Yao, M., Welsch, E., Herbig, M., Friák, M., Lipińska-Chwałek, M., Hickel, T., Scheu, C., Raabe, D., & Neugebauer, J. (2016). Off-stoichiometric composition of κ carbide in Fe–Mn–Al–C steels: An ab-initio study combined with experiment. Poster presented at ADIS 2016 Workshop, Tegernsee, Germany. [PubMan] : Fabritius, H.-O., Ziegler, A. S., Friák, M., Nikolov, S. D., Huber, J., Seidl, B., Lu, J., Janus, A. M., Petrov, M., Zhu, L.-F., Hemzalová, P., Hemzalová, P., Hild, S., Raabe, D., & Neugebauer, J. (2016). Functional adaptation of crustacean exoskeletal elements through structural and compositional diversity: a combined experimental and theoretical study. Bioinspiration & Biomimetics, 11(5): 055006. doi:10.1088/1748-3190/11/5/055006. [PubMan] : Hüter, C., Friák, M., Weikamp, M., Neugebauer, J., Goldenfeld, N. D., Svendsen, B., & Spatschek, R. P. (2016). Nonlinear elastic effects in phase field crystal and amplitude equations: Comparison to ab initio simulations of bcc metals and graphene. Physical Review B, 93(21): 214105. doi:10.1103/PhysRevB.93.214105. [PubMan] : Dey, P., Nazarov, R., Dutta, B., Yao, M., Herbig, M., Friák, M., Hickel, T., Raabe, D., & Neugebauer, J. (2016). An ab-initio prediction of the off-stoichiometry of Fe–Mn–Al–C κ carbides. Talk presented at CALPHAD XLV. Awaji Island, Hyogo, Japan. 2016-05-29 - 2016-06-03. [PubMan] : Dey, P., Nazarov, R., Dutta, B., Yao, M., Herbig, M., Friák, M., Hickel, T., Raabe, D., & Neugebauer, J. (2016). Origin of the off-stoichiometry of Fe–Mn–Al–C κ carbides: An ab-initio explanation of atom probe tomography data. Talk presented at DPG 2016. Regensburg, Germany. 2016-03-06 - 2016-03-11. [PubMan] : Střelcová, Z., Kulhánek, P., Friák, M., Fabritius, H.-O., Petrov, M., Neugebauer, J., & Koča, J. (2016). The structure and dynamics of chitin nanofibrils in an aqueous environment revealed by molecular dynamics simulations. RSC Advances, 6(36), 30710-30721. doi:10.1039/c6ra00107f. [PubMan] : Pei, Z., Friák, M., Sandlöbes, S., Nazarov, R., Svendsen, B., Raabe, D., & Neugebauer, J. (2015). Rapid theory-guided prototyping of ductile Mg alloys: from binary to multi-component materials. New Journal of Physics, 17(9): 093009. doi:10.1088/1367-2630/17/9/093009. [PubMan] : Friák, M., Tytko, D., Holec, D., Choi, P.-P., Eisenlohr, P., Raabe, D., & Neugebauer, J. (2015). Synergy of atom-probe structural data and quantum-mechanical calculations in a theory-guided design of extreme-stiffness superlattices containing metastable phases. New Journal of Physics, 17(9): 093004. doi:10.1088/1367-2630/17/9/093004. [PubMan] : Dey, P., Nazarov, R., Dutta, B., Yao, M., Herbig, M., Friák, M., Hickel, T., Raabe, D., & Neugebauer, J. (2015). Ab initio explanation of off-stoichiometry in Fe–Mn–Al–C κ carbides. Talk presented at Intermetallics 2015. Bad Staffelstein, Germany. 2015-09-28 - 2015-10-02. [PubMan] : Pei, Z., Ma, D., Friák, M., Svendsen, B., Raabe, D., & Neugebauer, J. (2015). From generalized stacking fault energies to dislocation properties: Five-energy-point approach and solid solution effects in magnesium. Physical Review B, 92(6): 064107. doi:10.1103/PhysRevB.92.064107. [PubMan] : Ma, D., Friák, M., von Pezold, J., Neugebauer, J., & Raabe, D. (2015). Ab initio study of compositional trends in solid solution strengthening in metals with low Peierls stresses. Acta Materialia, 98: 12303, pp. 367-376. doi:10.1016/j.actamat.2015.07.054. [PubMan] : Kuzmina, M., Choi, P.-P., Ma, D., Hickel, T., Neugebauer, J., Friák, M., Herbig, M., Ponge, D., Tasan, C. C., Sandlöbes, S., & Raabe, D. (2015). Scale hoping simulations and real atoms. Talk presented at ICAMS Workshop ‘From Atoms to Continuum’,ICAMS, Ruhr University Bochum. Bochum, Germany. 2015-06-16. [PubMan]