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Durham University

Solid-State NMR Group

pNMRsim: a general simulation program for large problems in solid-state NMR

News

pNMRsim update

This update (V15.08.13) adds various features / fixes, including the ability to switch ordering conventions for tensor axes. Note that the default nuclear spin properties are now standardised on "IUPAC" values (matching e.g. SIMPSON) which may differ very slighly from previous values. See documentation for details of changes.

(2 Mar 2016)


Modest pNMRsim update

This version (V13.08.08) involves minor updates (including a fix to a very edge case) to core functionality, plus experimental features such as detailed density matrix statistics. 

(17 Dec 2013)