patching clients

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Dec 14, 2018, 5:59:54 AM12/14/18

to ipi-users

Troubles again

In the documentation could read:

"before CP2K can run with i-PI, the code must be adapted to use the socket interface.

For this purpose i-PI is distributed with patch files in the directory “patches”

But could find no directory with the name "Patches" or similar within the last distribution tree

Possibly, as a new (potential) user, misunderstood something?

All the best

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Dec 14, 2018, 9:37:44 AM12/14/18

to ipi-users

Sorry, we are working on updating the documentation. This is an old statement.

CP2K "accepts" i-PI out of the box, no need to do anything about it. In the CP2K documentation

you can find out how to turn on the communication, and there are input examples for

CP2K in the "examples" folder.

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Dec 14, 2018, 9:38:08 AM12/14/18

to ipi-users

That part of the documentation is obsolete - now Q-E, CP2K, LAMMPS and many other codes have built-in connection to i-PI.

We're updating the docs, there's a pull request here https://github.com/i-pi/i-pi/pull/11

If you spot other inconsistencies report them there so we can merge it all at once.

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