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Bug #1645388: Reading DM file with different spin order

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636. By Nick Papior on 2016-12-13

Updated manual

635. By Nick Papior on 2016-12-12

Made final spin-printout equivalent to the initial spin-printout

This should clarify any differences between the two.

634. By Nick Papior on 2016-12-11

Fixed spin-print-out for initial spin-configuration

Updated documentation to reflect the reading of a DM with
different spin-order.

633. By Nick Papior on 2016-12-09

Restructured new_DM for easier changes

The m_new_DM routine has recieved an overhaul.
The initialization routines are re-implemented
and tested with the tests in the test directories.
 fe_noncollinear and transiesta ts_au
There is no logic change in this commit.
Also tested with OpenMP.

632. By Nick Papior on 2016-12-08

Enabled reading of DM with different spin-components

This is handy for doing large scale calculations with
multiple spins. First start by calculating the non-polarized
case, then increase spin to polarized, then increase to
non-collinear, and finally to spin-orbit. This has been
tested on a very simple system to check it works.
 siesta -fdf Spin:none run.fdf
 siesta -fdf Spin:polarized run.fdf
 ...
will now work.
This partially fixes lp:1645388.

The reading/writing of DM has changed to not take into account the
number of spin-components. Thus checks for spin should be taken care
of after reading DM (for TS and S).

631. By Nick Papior on 2016-12-07

Fixed bug when printing initial spin-difference

This bug was introduced in r590.

630. By Nick Papior on 2016-12-05

Merged 4.0-r508, reverted merge (no changes required)

629. By Nick Papior on 2016-12-05

Fixed non-collinear and spin-orbit PDOS in serial

Partially fixes lp:1645749.

There was a factor of 2 mixing to print the magnetization,
this is now fixed both for PDOS output and XML output.

628. By Nick Papior on 2016-12-05

Removed FoX format specifier when it can not be used

Fixes lp:1647073.

Also limited number of fields for single precision
numbers by default in the xml output routines.
A single precision number only has 7 significant
digits, so we limit the output to that amount,
instead of the previous 12 digits.

627. By Nick Papior on 2016-11-29

Updated the way the date is printed in the manual

Now the date tag is automaticly updated when the
release.sh script is runned. This makes it easier
to track.
Also, one should change the \date macro before
the begin{document} to change the date.