QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: Aadhityan on January 28, 2017, 18:40

Title: TMR bonding problem
Post by: Aadhityan on January 28, 2017, 18:40

Some of the oxides gets bonded with electrode material(Particularly I used nickel with Mgo) after optimization. I tried with different initial length between electrode and the insulator(MgO). Is it normal in TMR? Because in your example section, I found there is no bonding between insulator and the electrode

Title: Re: TMR bonding problem
Post by: Anders Blom on January 29, 2017, 09:49

See https://www.quantumwise.com/component/fsj_faqs/faq/846-bonds-between-some-atoms-are-missing