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codestructure [2013/10/10 14:29] – [Data Structure of Key Variables] 159.92.9.130codestructure [2013/12/25 15:55] – [File Names] 79.224.221.244
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   * ''qs_*'' for Quickstep related source codes (Hamiltonian construction, integration, collocation, energy minimisation and SCF cycle etc)   * ''qs_*'' for Quickstep related source codes (Hamiltonian construction, integration, collocation, energy minimisation and SCF cycle etc)
-  * ''xc_*'' for Exchange-Correlation functionals used by Quickstep ''md_*'' for Molecular Dynamics related source codes+  * ''xc_*'' for Exchange-Correlation functionals used by Quickstep  
 +  * ''md_*'' for Molecular Dynamics related source codes
   * ''mc_*'' for Quantum Monte Carlo related source codes   * ''mc_*'' for Quantum Monte Carlo related source codes
   * ''fist_*'' for FIST classical MD related source codes   * ''fist_*'' for FIST classical MD related source codes
dev/codestructure.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1