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QuantumATK => General Questions and Answers => Topic started by: abhishek77492652 on January 5, 2018, 14:10

Title: HOMO-LUMO at different bias
Post by: abhishek77492652 on January 5, 2018, 14:10

How we can find Homo-Lumo  gap at different bias in vnl-atk?

Title: Re: HOMO-LUMO at different bias
Post by: Petr Khomyakov on January 6, 2018, 13:16

Take a look at the section "The Molecular Projected Self-Consistent Hamiltonian" in this tutorial https://docs.quantumwise.com/tutorials/molecular_device/molecular_device.html.