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External potential
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Paratec http://www.nersc.gov/projects/paratec5.1 Documentation
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Options for improved stress
 
Contents
Getting extra outputs and other interesting stuff
Subsections
External potential
NMR shift
Additional Files
NMR options
Running NMR jobs
Calculating the induced current
NMR shift
Band structure computation
Density of states (DOS)
Momentum density
GW Interface and Usage
GW Interface
Example: Si
Visualization
Tensor Data
Line plots
Slice plots
Visualizing wave functions
Visualizing the charge density
Plotting the potential
Ball and stick model
Spin polarized calculations and magnetic field
Applying a magnetic field
Reading additional input
Getting additional output
Jonathan Yates 2001-05-10