Add to ORKGTwo different preparation methods, liquid-quenching and evaporation of amorphous selenium have been investigated by molecular dynamics simulations. We applied a classical empirical threebody potential of selenium to describe the interactions between atoms. Our particular aim was to determine how the structural changes occur due to the different preparation methods. Our simulation shows that a significant difference can be observed in the homogeneities
We discuss two examples of computer simulation of liquid semiconductors by two different techniques....
Computer simulations have been carried out in order to study thermal and dynamical properties of dif...
A semiempirical tight-binding energy model is developed for selenium. It includes s and p electro...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
We report a molecular dynamics simulation of selenium, described by a three-body interaction. The te...
Molecular dynamics simulations using a density functional description of energies and forces have be...
Molecular dynamics simulations using a density functional description of energies and forces have be...
Molecular dynamics simulations using a density functional description of energies and forces have be...
We report molecular dynamics simulations of liquid and amorphous Se at pressures from 0 to 6 GPa for...
Molecular dynamics simulations of liquid and glassy selenium have been carried out using density fun...
Molecular dynamics simulations of liquid and glassy selenium have been carried out using density fun...
Car-Parrinello molecular dynamics calculations have been carried out for a single P4Se3 molecule and...
Car-Parrinello molecular dynamics calculations have been carried out for a single P4Se3 molecule and...
We discuss two examples of computer simulation of liquid semiconductors by two different techniques....
Computer simulations have been carried out in order to study thermal and dynamical properties of dif...
A semiempirical tight-binding energy model is developed for selenium. It includes s and p electro...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
The structure of amorphous selenium has been studied using molecular dynamics. Ten chains of seleniu...
We report a molecular dynamics simulation of selenium, described by a three-body interaction. The te...
Molecular dynamics simulations using a density functional description of energies and forces have be...
Molecular dynamics simulations using a density functional description of energies and forces have be...
Molecular dynamics simulations using a density functional description of energies and forces have be...
We report molecular dynamics simulations of liquid and amorphous Se at pressures from 0 to 6 GPa for...
Molecular dynamics simulations of liquid and glassy selenium have been carried out using density fun...
Molecular dynamics simulations of liquid and glassy selenium have been carried out using density fun...
Car-Parrinello molecular dynamics calculations have been carried out for a single P4Se3 molecule and...
Car-Parrinello molecular dynamics calculations have been carried out for a single P4Se3 molecule and...
We discuss two examples of computer simulation of liquid semiconductors by two different techniques....
Computer simulations have been carried out in order to study thermal and dynamical properties of dif...
A semiempirical tight-binding energy model is developed for selenium. It includes s and p electro...