! ! Copyright (C) 2004 PWSCF group ! This file is distributed under the terms of the ! GNU General Public License. See the file `License' ! in the root directory of the present distribution, ! or http://www.gnu.org/copyleft/gpl.txt . ! ! !--------------------------------------------------------------- subroutine series(f,r,r2,b) !--------------------------------------------------------------- ! use kinds, only : DP implicit none real(DP):: dr21,dr31,dr32,dr41,dr42,dr43,df21,df32,df43, & ddf42,ddf31 real(DP):: f(4),r(4),r2(4),b(0:3) dr21=r(2)-r(1) dr31=r(3)-r(1) dr32=r(3)-r(2) dr41=r(4)-r(1) dr42=r(4)-r(2) dr43=r(4)-r(3) df21=(f(2)-f(1))/dr21 df32=(f(3)-f(2))/dr32 df43=(f(4)-f(3))/dr43 ddf42=(df43-df32)/dr42 ddf31=(df32-df21)/dr31 b(3)=(ddf42-ddf31)/dr41 b(2)=ddf31-b(3)*(r(1)+r(2)+r(3)) b(1)=df21-b(2)*(r(2)+r(1))-b(3)*(r2(1)+r2(2)+r(1)*r(2)) b(0)=f(1)-r(1)*(b(1)+r(1)*(b(2)+r(1)*b(3))) return end subroutine series