[molpro-user] sapt error reg

[Uma Devi]

dear all,
 I am doing sapt calculation for simple dimers. i got some error like NAN
in the energy ranges like below

 E1pol                -900.26589879          ( -0.90026590E+03)
-564.9250      -2363.6481
 E1exch               -259.09880207          ( -0.25909880E+03)
-162.5868       -680.2639
 E1exch(S2)           -246.01615011          ( -0.24601615E+03)
-154.3773       -645.9154
 E2ind(unc)          -5762.58747353          ( -0.57625875E+04)
 -3616.0755     -15129.6734
 E2ind                          NaN                           (  NaN)
              NaN             NaN
 E2ind-exch                     NaN                         ( NaN)
           NaN             NaN
 E2disp(unc)           271.84010983           (  0.27184011E+03)
 170.5821        713.7162
 E2disp                         NaN                              (NaN)
                     NaN             NaN
 E2disp-exch(unc)    -1477.38977150          ( -0.14773898E+04)
-927.0754      -3878.8868
 E2disp-exch                    NaN                              (  NaN)
              NaN             NaN

 E1tot               -1159.36470087          ( -0.11593647E+04)
-727.5118      -3043.9120
 E2tot                          NaN                            (NaN)
          NaN             NaN
 E1tot+E2tot                    NaN                            ( NaN)
          NaN             NaN

please help me to correct the mistake

*UMADEVI PALANIVEL*
RESEARCH SCHOLAR,
MOLECULAR QUANTUM MECHANICS LABORATORY,
DEPARTMENT OF PHYSICS,
BHARATHIAR UNIVERSITY,
COIMBATORE*.*
**

*REALITY IS FOR PEOPLE WHO CAN'T FACE SCIENCE FICTION.*
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