Assign quantum numbers and call routine to solve 8 coupled differentail radial
Dirac eqautions. The resulting wavefunctions are used to calculate t-matrices in
the representation.
Calculation of the radial integrals:
for IHYPER <> 0
. Calculation of the hyperfine matrix elements.
Note
JG/JF
and PR/QR
to share the same storage by
corresponding argument list in CALL
.P
,Q
used in <DIRAC>
instead of g
,f
Type | Intent | Optional | Attributes | Name | ||
---|---|---|---|---|---|---|
integer | :: | iwrregwf | ||||
integer | :: | iwrirrwf | ||||
integer | :: | nfilcbwf | ||||
logical | :: | calcint | ||||
logical | :: | getirrsol | ||||
real(kind=dp) | :: | soctl(ntmax,nlmax) | ||||
real(kind=dp) | :: | ctl(ntmax,nlmax) | ||||
complex(kind=dp) | :: | eryd | ||||
complex(kind=dp) | :: | p | ||||
integer | :: | ihyper | ||||
integer | :: | iprint | ||||
integer | :: | ikm1lin(linmax) | ||||
integer | :: | ikm2lin(linmax) | ||||
integer | :: | nlq(nqmax) | ||||
integer | :: | nkmq(nqmax) | ||||
integer | :: | nlinq(nqmax) | ||||
integer | :: | nt | ||||
integer | :: | nkm | ||||
integer | :: | iqat(nqmax,ntmax) | ||||
complex(kind=dp) | :: | tsst(nkmmax,nkmmax,ntmax) | ||||
complex(kind=dp) | :: | msst(nkmmax,nkmmax,ntmax) | ||||
complex(kind=dp) | :: | tsstlin(linmax,ntmax) | ||||
complex(kind=dp) | :: | dzz(linmax,ntmax) | ||||
complex(kind=dp) | :: | dzj(linmax,ntmax) | ||||
complex(kind=dp) | :: | szz(linmax,ntmax) | ||||
complex(kind=dp) | :: | szj(linmax,ntmax) | ||||
complex(kind=dp) | :: | ozz(linmax,ntmax) | ||||
complex(kind=dp) | :: | ozj(linmax,ntmax) | ||||
complex(kind=dp) | :: | bzz(linmax,ntmax) | ||||
complex(kind=dp) | :: | bzj(linmax,ntmax) | ||||
complex(kind=dp) | :: | qzz(linmax,ntmax) | ||||
complex(kind=dp) | :: | qzj(linmax,ntmax) | ||||
complex(kind=dp) | :: | tzz(linmax,ntmax) | ||||
complex(kind=dp) | :: | tzj(linmax,ntmax) | ||||
real(kind=dp) | :: | vt(nrmax,ntmax) | ||||
real(kind=dp) | :: | bt(nrmax,ntmax) | ||||
real(kind=dp) | :: | at(nrmax,nlamax,3,ntmax) | ||||
integer | :: | zat(ntmax) | ||||
integer | :: | nucleus | ||||
real(kind=dp) | :: | r(nrmax,nmmax) | ||||
real(kind=dp) | :: | drdi(nrmax,nmmax) | ||||
real(kind=dp) | :: | r2drdi(nrmax,nmmax) | ||||
integer | :: | jws(nmmax) | ||||
integer | :: | imt(ntmax) | ||||
real(kind=dp) | :: | ameopo(nkmmax,nkmmax,nlamax,3) | ||||
integer | :: | lopt(ntmax) | ||||
character(len=10) | :: | solver | ||||
real(kind=dp) | :: | cgc(nkmpmax,2) | ||||
complex(kind=dp) | :: | ozzs(linmax,ntmax,2) | ||||
complex(kind=dp) | :: | ozjs(linmax,ntmax,2) | ||||
integer | :: | nlmax | ||||
integer | :: | nqmax | ||||
integer | :: | linmax | ||||
integer | :: | nrmax | ||||
integer | :: | nmmax | ||||
integer | :: | ntmax | ||||
integer | :: | nkmmax | ||||
integer | :: | nkmpmax | ||||
integer | :: | nlamax |