[Pw_forum] problem in lderiv curves for Sr pseuopotentials
karan deep
karandeepster at gmail.com
Mon Aug 29 17:19:14 CEST 2011
i am trying to generate pseudopotentials for LDA in Sr
i don't know why logarithmic derivatives are showing extra what u can call
them spikes in original wave functions. i am attaching my input as well as
ldplot files here
thanks for all reply
Karandeep
Research Scholar
Physics Department,
IIT, Delhi
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