Elk version 1.3.20 has just been released.
This release is mainly for bug fixes and minor changes.
Kay Dewhurst, Sangeeta Sharma, Lars Nordstrom, Francesco Cricchio, Fredrik Bultmark and Hardy Gross
-added directionality to the TDDFT code; thanks also to Vladimir Nazarov for discussions
-a pre-print is now available for the new TDDFT 'bootstrap' kernel: arXiv:1107.0199v1 [cond-mat.mtrl-sci]
-added the scissor correction to the RPA inverse dielectric function in EPSINV_RPA.OUT
-fixed a problem with running geometry optimisation with MPI; thanks to
Arkady Davydov and Antonio Sanna for discussions
-geometry optmimisation has changed: now the geometry, interatomic distances, final total energies and forces are stored for each optimisation step in GEOMETRY_OPT.OUT, IADIST_OPT.OUT, TOTENERGY_OPT.OUT and FORCES_OPT.OUT
-removed geometry optmisation from the ground-state calculation and put it in a separate subroutine
-reduced pseudocharge density constant (lnpsd) because the spherical
bessel function order could be too large; may change total energies slightly
-q-points and weights written to QPOINTS.OUT
-minor changes and optimisations
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