The relative phase stability of fcc and bcc Cr–Fe–Mn–Ni alloys has been investigated using a combination of density functional theory, cluster expansion (CE), and Monte Carlo (MC) simulations. The MC simulations for fcc and bcc Cr–Fe–Mn–Ni alloys performed using the CE models enabled...
Full size image We now turn to investigate the adjustment during the process of prismatic HCP-FCC transformation. As shown in Fig. 1 and related before, the interplanar spacing of HCP {101¯0} between D and A is quite different from that between A and B, while the interplanar spacing of...
The earlier integration of validated Lennard–Jones (LJ) potentials for 8 fcc metals into materials and biomolecular force fields has advanced multiple research fields, for example, metal–electrolyte interfaces, recognition of biomolecules, colloidal as
Using results from numerical simulations, we show here how this acoustic variation has the correct form and amplitude needed to account for the previously observed solar photometric changes. In this picture, both the acoustic and irradiance changes may be caused by magnetically induced entropy ...
Because HEAs are composed of many components, most of them form single solid solution phases such as BCC [4,5], FCC [7,8] or HCP [6,7]. Besides, there are also Laves phase and σ phase. Show abstract Twenty years of the CoCrFeNiMn high-entropy alloy: achieving exceptional mechanical...
This makes DMD a valuable technique in the creation of solids from otherwise immiscible materials, such as BCC-FCC two phase systems made from BCC metals like iron, molybdenum, tungsten and tantalum, mixed with an FCC metal like copper. The creation of these multiphase materials by DMD is ...
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Dify is an open-source LLM app development platform. Dify's intuitive interface combines AI workflow, RAG pipeline, agent capabilities, model management, observability features and more, letting you quickly go from prototype to production. - dify/api/poe
For higher order clusters, the total number of decorations depend on the cluster coordinates and the space group symmetry G of the high temperature disordered phase i.e., FCC or BCC and can not be simply expressed in terms of K (in general there could be less than (𝜔+𝐾−1𝐾...
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