dc.description.abstract |
Investigations of the total energy, the stTuctuml and electTOnic pTOper'lies of Lan
thmmm have been caTTied out in the face-centered-wbic (fcc) and double hexagonal-
)
close packed (dhqJ) phases using a genemlized gmdient appm'l;imn,/,ion of the density
fu,l/,cl'iurwl theu'!'!) and the ab initiu pscudoputentiu,l we/JwrJ. DiYcw{/ces in /Ju density
of states at the Fermi level between these two phases u:!'c pointed oul and discnsscd
7>n detail, The electron-phonon coupling para:meter /\ is found to be 0. .97 and 1. OC for
the double he.mgonal-close-packed phase and face ccnleTed- cub'ic phase Tespedively.
Fur'lher-more the superconducting critical tempemture is estimated to be 4,87K (dhcp)
and 5.88K (lcc) respectively. and are in good agreement with ewerimental values of
(ITOund 5. Of,; (rlhcp) and 6. OJ( (fcc). 1\ few superconduding pammeters faT the dou
ble
he:mgonal-cluse-packed phase lw:ue been calC'u,lated and compared wdh available
IJI,eoTdical
and c:rpeTimental Tesulls. Fartherm,orc, the wlcnlatcd supeTcondv,ct'ing pa
'1ameleT's
fOT bolh phases (LTC wmpan~d bel.ween each olheT 'tn del,ail. |
en_US |