[Wien] The results of the 2Doptimize package
Abderrahmane Reggad
jazairdz at gmail.com
Sat Jan 7 21:07:30 CET 2017
Thank you Dr Guechi for your answer
Now how to solve this problem
Iteration 23
WSSR : 5.95105e-25 delta(WSSR)/WSSR : -0.343082
delta(WSSR) : -2.0417e-25 limit for stopping : 1e-05
lambda : 1.12698e+07
resultant parameter values
a1 = -1536.32
a2 = 14.9665
a3 = -0.0546001
a4 = 8.8495e-05
a5 = -5.37664e-08
*************
The maximum lambda = 1.000000e+20 was exceeded. Fit stopped.
final sum of squares of residuals : 5.95105e-25
rel. change during last iteration : 0
Exactly as many data points as there are parameters.
In this degenerate case, all errors are zero by definition.
Final set of parameters
=======================
a1 = -1536.32
a2 = 14.9665
a3 = -0.0546001
a4 = 8.8495e-05
a5 = -5.37664e-08
fit: -1536.32, 14.9665, -0.0546001, 8.8495e-05, -5.37664e-08
#####################################
Vol-opt= 315.2106 , coa-opt= -2.901
Runtime warning (func=e, adr=123): scale too large, set to 2147483647
<%28214%29%20748-3647>
Fatal error: Out of memory for malloc.
(standard_in) 2: syntax error
a0= , c0= bohr
(standard_in) 1: syntax error
(standard_in) 1: syntax error
a0= , c0= Ang
#####################################
Do you want a hardcopy? (Y/n)y
Specify a filename (default is 2DALP.ps)
Printing hardcopy
2DALP.ps generated
***************************************************************
I did your calculations. *
At the moment your NiS-afmI-opt2D_EE05.struct is orginal struct and
*
all of your NiS-afmI-opt2D_EE05.Vconst* files are in the present
directory.*
***************************************************************
Would you like to add some points to these calculations?(y/N)n
************************************************************************
Preparing 'NiS-afmI-opt2D_EE05.ene' and 'NiS-afmI-opt2D_EE05.latparam'
for x eosfit6 command
************************************************************************
Best regards
--
Mr: A.Reggad
Laboratoire de Génie Physique
Université Ibn Khaldoun - Tiaret
Adresse: BP 144 AL ATTAF AIN DEFLA
Tel: +213(0)561861963
Algerie
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