A simulated amorphization and recrystallization technique has been used to explore how a polycrystalline metal-oxide thin film can be synthesized selectively on an MgO(100) substrate. The simulations indicate that by introducing a polycrystalline SrO "buffer-layer", sandwiched between the support and overlying thin film, polycrystalline thin films of CaO and BaO can be fabricated. Conversely, our findings suggest that without the buffer layer, neither the CaO nor the BaO exhibit polycrystallinity when supported on an MgO(100) substrate. This suggests that the polycrystalline buffer layer acts as a template in directing the structure of the overlying metal oxide resulting in polycrystalline thin films
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
Thin film oxide-oxide interfaces with associated lattice misfits ranging from -20 to +27%, have been...
Realistic atomistic simulation models of interfaces must include a sufficiently large simulation cel...
Large-scale atomistic simulations of oxide interfaces have been performed where the thin film is for...
When supported, thin films demonstrate remarkable structural transformations, with important implic...
The atomistic structures of SrO (15×15×2.2nm), CaO (14×14×2nm), and MgO (12×12×2nm) nanoparticles, s...
Simulated amorphisation and recrystallisation has been employed to explore the structure of ultra-th...
We present the first simulation of an ultra-thin supported oxide, which encompasses, within a single...
Atomistic computer simulation techniques have been employed to generate an amorphous SrO thin film o...
Supported materials have been constructed by successively depositing ions onto a surface in conjunct...
A simulated amorphization and recrystallization strategy has been used to generate atomistic models ...
Preparation and application possibilities for thin film model systems of isolated pure oxides and mi...
In this thesis, a systematic study of preparation of artificially layered oxide materials is present...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
Thin film oxide-oxide interfaces with associated lattice misfits ranging from -20 to +27%, have been...
Realistic atomistic simulation models of interfaces must include a sufficiently large simulation cel...
Large-scale atomistic simulations of oxide interfaces have been performed where the thin film is for...
When supported, thin films demonstrate remarkable structural transformations, with important implic...
The atomistic structures of SrO (15×15×2.2nm), CaO (14×14×2nm), and MgO (12×12×2nm) nanoparticles, s...
Simulated amorphisation and recrystallisation has been employed to explore the structure of ultra-th...
We present the first simulation of an ultra-thin supported oxide, which encompasses, within a single...
Atomistic computer simulation techniques have been employed to generate an amorphous SrO thin film o...
Supported materials have been constructed by successively depositing ions onto a surface in conjunct...
A simulated amorphization and recrystallization strategy has been used to generate atomistic models ...
Preparation and application possibilities for thin film model systems of isolated pure oxides and mi...
In this thesis, a systematic study of preparation of artificially layered oxide materials is present...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...
The influence of the composition on the crystallographic properties of deposited Mg(M)O (with M=Al, ...