mirror of https://gitlab.com/QEF/q-e.git
Minor documentation updates
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@12137 c92efa57-630b-4861-b058-cf58834340f0
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@ -1,4 +1,9 @@
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Fixed in svn version:
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New in 5.3.1 version:
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* Calculation of the Magnetic anisotropy energy is implemented (in the limit
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of small spin-orbit coupling) using the Force theorem (A. Smogunov)
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Fixed in 5.3.1 version:
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* New configure wasn't working properly for some Macintosh due to a
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missing line (commit 11976)
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@ -12,8 +17,10 @@ Fixed in svn version:
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for 'mv' and 'mp' smearing (courtesy of Tae Yun Kim and Cheol-Hwan Park,
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Seoul National University) (commit 12082)
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Incompatible changes in 5.3.0 version:
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Incompatible changes in 5.3.1 version:
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* k+G indices "igk" no longer written to and read from file (PW only,
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will be extended to all codes)
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* Module "gvecw", in Modules/gvecw.f90, includes previous CP module "gvecw"
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and several PW variables taken out from module "wvfct":
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qcutz, ecfixed, q2sigm, ecutwfc
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@ -108,7 +108,8 @@ late Prof. Eyvaz Isaev.
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Other contributors include: Lorenzo Paulatto (Univ. Paris VI) for
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PAW, 2n+1 code; William Parker (Argonne) for phonon terms in dielectric
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tensor.
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tensor; Tobias Wassmann (Univ. Paris VI) for third-order derivatives of GGA
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potential.
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We shall greatly appreciate if scientific work done using this code will
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contain an explicit acknowledgment and the following reference:
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@ -123,6 +123,8 @@ and many others. We quote in particular:
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\end{itemize}
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and the more recent contributors:
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\begin{itemize}
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\item Taylor Barnes (LBL) amd Ncola Varini (CSCS) for improvements
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to hybrid functionals;
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\item Thomas Markovich (Harvard) for Tkatchenko-Scheffler stress in PWscf;
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\item Jong-Won Song (RIKEN) for Gau-PBE functional;
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\item Alberto Otero de la Roza (Merced Univ.) for XDM (exchange-hole
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