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General Questions and Answers / silicon-sio2 interface define, optimize and make device
« on: December 12, 2013, 15:59 »
Hi there
I need to simulate a si-sio2 system consisted of si-nano crystalls embedded in a sio2 matrix. I 'd like to know if the ATK is able to optimize the structure and calculate electrical characteristics of a si-sio2 system? I mean does it have appropriate libraries and pseudo potentials included?
does the quick optimization work for si and sio2? how about the optimize geometry tool?
what is the best configuration for simulating a system of si-sio2?
Regards
I need to simulate a si-sio2 system consisted of si-nano crystalls embedded in a sio2 matrix. I 'd like to know if the ATK is able to optimize the structure and calculate electrical characteristics of a si-sio2 system? I mean does it have appropriate libraries and pseudo potentials included?
does the quick optimization work for si and sio2? how about the optimize geometry tool?
what is the best configuration for simulating a system of si-sio2?
Regards