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PAICS

Parallelized ab initio Calculation System based on FMO


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HOW TO GET
From April, 2012, the source code is open to the public free of charge with an English manual and order form. The following functions are available:
* base system of the FMO calculation
* molecular integral calculation
* RHF calculation (energy and gradient)
* MP2 calculation (energy and gradient)
* RI-MP2 calculatoin (energy and gradient)
* local MP2 calculation (energy)
Step to get the source code is as follows:
1. Recognition of a license agreement
2. User's registration
3. The source code is sent by e-mail
If you want to get the source code of PAICS, please move to the recognition page of a license agreement.
recognition page of a license agreement
You can get the manual of PAICS by the following link:
manual of PAICS
manual of PAICS (old, japanese)