3ddhss.inp

来自「A program for computing energy levels, r」· INP 代码 · 共 9 行

   &PARAM TITLE='  Half bound state energy level of the 2D problem  '
          IPTYPE=0,NROOT=1,MDIM=6,IDIM=2,NPOL=4,RTOL=1.D-13,
          NITEM=100,SHIFT=-0.2742D0,IPRINT=0,IPRSTP=100,
          NMESH=5,RMESH=0.0D0,100.D0,10.D0,1500.D0,500.D0,
          NDIR=2, NDIL=1,6, NMDIL=0,
          IBOUND=8, 
          FNOUT='3DNHBS.LPR',IOUT=7,POTEN='3DNHBS.PTN',IOUP=10,
          FMATR='3DNHBS.MAT',IOUM=11,EVWFN='3DNHBS.WFN',IOUF=0
   &END