mirror of https://github.com/abinit/abinit.git
23 lines
731 B
Plaintext
23 lines
731 B
Plaintext
TUTORIAL ON LINEAR AND NON-LINEAR RESPONSES TO ELECTRIC FIELDS
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Summary_NLO.txt
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summary of the results obtained for various properties using either
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response function or finite difference techniques.
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P0-STRUCT
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structural optimization of AlAs to be used all along the tutorial
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(i.e. recomputed with the convergence parameters of the tutorial)
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P1-DFPT
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Linear and non-linear responses of AlAs to electric field and
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atomic displacements using DFPT.
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P2-BERRY
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Berry phase calculation under zero field to get different linear
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and non-linear responses from finite differences
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P3-EFIELD
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Finite electric field calculation using the method of Souza and
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Vanderbilt, to get different linear and non-linear responses
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from finite differences.
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