[Pw_forum] too many nodes for 1d1.x code

[lan haiping]

Hi,
 I am looking through the ld1.x code to  generate a ncpp for  Ti element .
Taking the pseudo-configuration from the opium package, and  suggestion of
Paolo's PP notation,  my calculations
alway complain "too many nodes".  I have tried to change the rcut for the
channels , and also set rho0  to nozero value to use
4 bessel functions . All these settings seem no success .   I also tried to
set tm as true to use TM pseudo scheme , but the code
complains 'too many attempts' this time .  Would you please give me some
suggestion to deal with these situation  ？ any comments
are appreciated.  my input is below!
 cheers,
hai-ping

cat > ti.in <<EOF
 &input
   title='Ti',
   zed=22.,
   rel=1,
   rlderiv=2.50,
   eminld=-4.0,
   emaxld=4.0,
   deld=0.02,
   nld= 2,
   iswitch=3,
   config='[Ar] 3d1 4s0 4p0'
   dft='PBE',
 /
 &inputp
   pseudotype=2,
   lloc= 1,
   rho0=0.01,
   file_pseudopw='Ti.RRKJ3.UPF',
 /
5
3S  1  0  2.00  0.00  1.80  2.00
3P  2  1  6.00  0.00  2.00  2.00
3D  3  2  1.00  0.00  2.00  2.00
4S  4  0  0.00  0.00  1.80  2.10
4P  5  1  0.00  0.00  2.20  2.20
EOF

-- 
Hai-Ping Lan
Department of Electronics ,
Peking University , Bejing, 100871
lanhaiping at gmail.com, hplan at pku.edu.cn
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