Difference between revisions of "Isoswap.m"
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[[Kernel_utilities#Spin_system_editing|Spin system editing]] | [[Kernel_utilities#Spin_system_editing|Spin system editing]] | ||
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''Version 2.9, authors: [[Ilya Kuprov]]'' | ''Version 2.9, authors: [[Ilya Kuprov]]'' | ||
Revision as of 12:27, 25 April 2026
Makes isotope replacements in the input structures. All interactions are automatically scaled as necessary.
Syntax
[sys,inter]=isoswap(sys,inter,spins,new_iso)
Arguments
sys, inter - Spinach input data structures
spins - a vector of integers specifying
spin numbers
new_iso - character string specifying
the new isotope
Outputs
sys, inter - Spinach input data structures
See also
Version 2.9, authors: Ilya Kuprov
