1c/////////////////////////////////////////////////////////////////////// 2c Distribution: FEFF6L 3c Copyright (c) [2002] University of Washington 4c 5c This software was prepared in part with US Government Funding under 6c DOE contract DE-FG03-97ER45623. 7 8c Redistribution and use of this Distribution in source and binary 9c formats, with or without modification is permitted, provided the 10c following conditions are met: 11c 12c Redistributions must retain the above notices and the following list 13c of conditions and disclaimer; 14c 15c Modified versions carry the marking 16c "Based on or developed using Distribution: FEFF6L 17c Copyright (c) [2002] University of Washington" 18c 19c Recipient acknowledges the right of the University of Washington to 20c prepare uses of this Distribution and its modifications that may be 21c substantially similar or functionally equivalent to 22c Recipient-prepared modifications. 23c 24c Recipient and anyone obtaining access to the Distribution through 25c recipient's actions accept all risk associated with possession and 26c use of the Distribution. 27c 28c THIS SOFTWARE IS PROVIDED ``AS IS'' AND ANY EXPRESS OR IMPLIED 29c WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED WARRANTIES OF 30c MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE DISCLAIMED. 31c IN NO EVENT SHALL THE UNIVERSITY OF WASHINGTON OR CONTRIBUTORS TO THE 32c DISTRIBUTION BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, 33c EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, 34c PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR 35c REVENUE; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF 36c LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING 37c NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS 38c SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE. 39c/////////////////////////////////////////////////////////////////////// 40c License is applicable for routines listed below, unless otherwise specified. 41c 42arrays.h diff.f ffq.f inouh.f mpprmd.f pola.h rpotph.f timrep.f 43atom.f fixvar.f inth.f mpprmp.f potph.f sclmz.f totale.f 44besjn.f dim.h fmatrx.h intpol.f mrb.f potsl.f sdist.f trap.f 45bjnser.f dirac.f fmtrxi.f ipack.f nlm.h potslw.f setgam.f vers.h 46ccrit.f dist.f fovrg.f istprm.f outcrt.f prcrit.f setlam.f wphase.f 47cdsld.f edp.f fpot.f istval.f ovrlp.f quinn.f sidx.f wpot.f 48chopen.f exchan.f frnrm.f lambda.h pathsd.f rdhead.f sigms.f xcpot.f 49clmz.h exchee.f genfmt.f paths.f rdinp.f snlm.f xx.f 50const.h exjlnl.f getorb.f Makefile pdata.h rdpath.f somm.f ykdir.f 51cpl0.f feffbd.f getxk.f mcrith.f pertab.f renorm.f sortix.f 52cright.f feff.f head.f mcritk.f phase.f rhl.f strap.f 53csomm.f heap.f mkptz.f phash.f rot3i.f str.f 54cubic.f fermi.f imhl.f mmtr.f phmesh.f rotmat.h sumax.f 55dalp.f ff2chi.f indata.f mmtrxi.f pijump.f rphbin.f terp.f 56 57