This document lists the names (keywords) of all input variables to be used in the main input file of the abinis code.
The new user is advised to read first the new user's guide, before reading the present file. It will be easier to discover the present file with the help of the tutorial.
When the user is sufficiently familiarized with ABINIT, the reading of the ~ABINIT/Infos/tuning file might be useful. For response-function calculations using abinis, the complementary file ~ABINIT/Infos/respfn_help is needed.
A. accesswff acell algalch amu angdeg
B. bdberry bdgw berryopt boxcenter boxcutmin brvltt bxctmindg
C. ceksph charge chkexit chkprim cmlfile cpus, cpum, cpuh
D. dedlnn delayperm densty diecut diegap dielam dielng diemac diemix dilatmx dosdeltae dsifkpt dtion
E. ecut ecuteps ecutsigx ecutsm ecutwfn effmass efield enunit eshift exchn2n3
F. fband fftalg fftcache fft_opt_lob fixmom freqsusin freqsuslo friction frzfermi
G. genafm getacfd getcell getddk getden getkss getocc getscr getvel getwfk getwfq getxcart getxred get1den get1wf get1wfden gwcalctyp
H.
I. iatcon iatfix iatfixx iatfixy iatfixz iatsph iboxcut idyson ikhxc intexact intxc ionmov iprcch iprcel iprcfc irdddk irdkss irdscr irdwfk irdwfq ird1wf iscf isecur istatr istatshft istwfk ixc ixcpositron
J. jdtset
K. kberry kpara kpt kptbounds kptgw kptnrm %kptns kptopt kptrlatt kptrlen kssform
M. %mband mdftemp mditemp mdwall mffmem %mgfft %mgfftdg mgriddg mixalch mkmem mkqmem mk1mem %mpw mqgrid
N. natcon natfix natfixx natfixy natfixz natom natrd natsph nband nbandkss nbandsus nbdblock nbdbuf nberry nctime nconeq ndivk ndtset ndyson %nelect %nfft %nfftdg nfreqsus ngfft ngfftdg ngkpt nkpt nkptgw nline nloalg nnsclo nomegasrd npack npara npsp %npspalch npulayit npweps npwkss npwsigx npwwfn nobj nomegasrd noseinert nqpt nqptdm nsheps nshiftk nshsigx nshwfn nspden nspinor nsppol nstep nsym ntime ntypalch ntypat %ntyppure
O. objaat, objbat objaax, objbax objan, objbn objarf, objbrf objaro, objbro objatr, objbtr occ occopt omegasrdmax optcell optdriver optforces optfreqsus optnlxccc optstress ortalg
P. parareel pawecutdg pawlcutd pawlmix pawnphi pawoptmix pawovlp pawprtvol pawntheta pawnzlm pawsphmix pawxcdev positron ppmfrq ppmodel prepanl prtacfd prtbbb prtcml prtden prtdos prteig prtfsurf prtgeo prtgkk prtkpt prtpot prtstm prtvha prtvhxc prtvol prtvxc prtwant prtwf prt1dm pspso %ptgroupma
Q. qprtrb qpt qptdm %qptn qptnrm
R. ratsph restartxf rfasr rfatpol rfdir rfelfd rfmeth rfphon rfstrs rfthrd rfuser rprim %rprimd rf1atpol rf1dir rf1elfd rf1phon rf2atpol rf2dir rf2elfd rf2phon rf3atpol rf3dir rf3elfd rf3phon
S. sciss shiftk signperm soenergy so_typat spgaxor spgorig spgroup spgroupma spinat splitsigc stmbias strfact strprecon strtarget suskxcrs symafm symrel symmorphi
T. td_maxene td_mexcit tfkinfunc tfnewton timopt tnons toldfe toldff tolmxf tolvrs tolwfr tphysel tsmear typat
U. udtset %usepaw useylm useria, userib, useric, userid, userie userra, userrb, userrc, userrd, userre
V. vaclst vacnum vacuum vacwidth vel vis vprtrb
Y.