Andrew M. Alvarado Hi Vo Tin Jan S. Wr´obel Damian Sobieraj Duc Nguyen-Manh Saryu Jindal Fensin Enrique Martinez Osman El-Atwani
We present a Density Functional Theory-based cluster expansion model to predict the configurational energy of a multicomponent W-Ta-Cr-V-Hf quinary alloy. Coupled with Monte Carlo simulations we show that the model reproduces experimental observations. We analyze the thermodynamic properties of the W.31Ta.34Cr.05V.27Hf.03 system and observe two ph…
PreprintTay Sparks Duc Nguyen-Manh Pengfei Zheng Jan S. Wróbel Michael Gorley Thomas Connolley Christina Reinhard Yiqiang Wang Biao Cai
Vanadium base alloys represent potentially promising candidate structural materials for use in nuclear fusion reactors due to vanadium’s low activity, high thermal strength, and good swelling resistance. In this work, the mechanical properties of the current frontrunner vanadium base alloy, V-4Cr-4Ti, have been interrogated using in-situ high ene…
Preprint PurchaseDamian Sobieraj Jan S. Wróbel Mark R. Gilbert Andrey Litnovsky Felix Klein Krzysztof J. Kurzydłowski Duc Nguyen-Manh
W-Cr-Y smart alloys are potential material candidates for plasma facing components due to their protective behaviour during the loss-of-coolant accident (LOCA), while maintaining beneficial properties of W during the normal operation of the fusion power plant. During plasma exposure the lighter alloying elements are preferentially sputtered at t…
PreprintD. Nguyen-Manh J.S. Wrobel M. Klimenkov M.J. Lloyd L. Messina S.L. Dudarev
Understanding how properties of materials change due to nuclear transmutations is a major challenge for the design of structural components for a fusion power plant. In this study, by combining a first-principles matrix Hamiltonian approach with thermodynamic integration we investigate quasisteady state configurations of multi-component alloys, …
PreprintA. Litnovsky F. Klein X. Tan J. Schmitz J. W. Coenen C. Linsmeier J. Gonzalez-Julian M. Bram I. Povstugar T. Morgan Y. M. Gasparyan A. Suchkov D. Bachurina D. Nguyen-Manh M. Gilbert D. Sobieraj J. S. Wróbel P. Bittner A. Reuban
Self-passivating Metal Alloys with Reduced Thermo-oxidation (SMART) are under development for the primary application as plasma-facing materials of the first wall in a fusion DEMOnstration power plant (DEMO). SMART materials must combine the suppressed oxidation in case of an accident and an acceptable plasma performance during the regular operatio…
Preprint PublishedM. J. Lloyd A. J. London M. Gilbert C. S. Becquart C. Domain E. Martinez M. Moody P. A. J. Bagot D. Nguyen-Manh D.E. J. Armstrong
Tungsten is one the primary candidate materials for the high neutron flux, high temperature components of a future demonstrate fusion reactor. Despite this, there is a lack of data on W under fusion relevant neutron doses and irradiation temperatures. Transmutation reactions result in the production of Re and Os solute atoms, at a rate which is …
Preprint PublishedM. J. Lloyd E. Martinez L. Messina D. Nguyen-Manh
In this study, radiation-induced precipitation of transmutation products is addressed via the development of a new solute and vacancy concentration dependant Ising model for the W-Re-Os system. This new model includes interactions between both Os and Re atoms, thus facilitating more representative simulations of transmutation in fusion reactor comp…
Preprint PublishedA. Fernandez-Caballero E. Bousser S.M. Shubeita P.T. Wady Y.Gue Ram Krishna M. Gorley D. Nguyen-Manh P. M. Mummery E.J. Pickering
One of the key challenges for the development of high-performance fusion materials is to design materials capable of maintaining mechanical and structural integrity under the extreme levels of displacement damage, high temperature and transmutation rates. High-entropy alloys (HEAs) and other concentrated alloys have attracted attention with rega…
Preprint PublishedDamian Sobieraj Jan S. Wróbel Tomasz Rygier Krzysztof J. Kurzydłowski Osman El Atwani Arun Devaraj Enrique Martinez Saez Duc Nguyen-Manh
The development of High-Entropy Alloys (HEAs) focuses on exploring compositional regions in multicomponent systems with all alloy elements in equal or near-equal atomic concentrations. Initially it was based on the main idea that high mixing configurational entropy contributions to the alloy free energy could promote the formation of a single so…
Preprint Published