NanoDCAL
Installation
Getting started
Theory
Tutorials
1. Molecular Electronics
2. Spin Devices
3. Semiconductor devices
4. 2D Materials
5. Photodetectors
6. Phonons and Thermoelectric properties
Input reference
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NanoDCAL
Tutorials
Tutorials
1. Molecular Electronics
1.1. Simple Molecular Device
1.2. Dynamic Conductance
2. Spin Devices
2.1. Zigzag graphene nanoribbon
2.2. Nickel-graphene interface
2.3. DFT+U
3. Semiconductor devices
3.1. Spin-orbit interaction (SOI)
3.2. Carrier effective mass
3.3. Complex energy band structure
4. 2D Materials
4.1. WSe2 monolayer
5. Photodetectors
5.1. Photocurrent in WSe2 monolayer
6. Phonons and Thermoelectric properties
6.1. Frozen phonon calculation
6.2. Thermoelectric properties of materials
6.3. Thermoelectric transport