********************************************************************** MRCC program system ********************************************************************** Written by Mihaly Kallay, Zoltan Rolik, Jozsef Csontos, Istvan Ladjanszki, Lorant Szegedy, Bence Ladoczki, and Gyula Samu Department of Physical Chemistry and Materials Science Budapest University of Technology and Economics Budapest P.O.Box 91, H-1521 Hungary www.mrcc.hu ************************ 2020-06-29 03:12:06 ************************* Executing minp... Reading input from MINP... Input file: iface=dirac calc=CCS mem=7500MB symm=0 nstate=8 refdet=vector 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Checking keyword combinations... Keywords: active=none agrid=LD0006-LD0302 basis= basopt=off bpcompo=0.985 bpcompv=0.98 calc=ccs ccprog=mrcc cctol=6 charge=0 cialg=disk ciguess=off cmpgrp=auto core=frozen dboc=off dendec=cholesky dens=0 dfalg=invsqrt dfbasis_cor=none dfbasis_scf=none dfintran=ovirt dft=off diag=david domrad=10.d0 drpaalg=fit ecp=auto edisp=off epert=none eps=0.975 excrad=1e30 excrad_fin=1e30 freq=0.0 gauss=spher geom=zmat gopt=off ghost=none gtol=7 hamilton=dc iface=dirac intalg=auto itol=10 lcorthr=loose lmp2dens=on lnoepso=3e-5 lnoepsv=1e-6 localcc=off maxact=off maxex=0 bfbasis=none mem=7500mb molden=on mult= nacto=0 nactv=0 naf_cor=off naf_scf=off nafalg=albe nchol=auto nstate=8 nsing=0 ntrip=0 occ= optalg= optmaxit=50 opttol=1e-6 orblocc=off orbloco=off orblocv=off osveps=1e-3 ovirt=off ovosnorb=80.0 popul=off qmmm=off refdet=vector rest=0 rgrid=gc rohftype=standard scspe=1.d0 scsps=1.2d0 scspt=0.33333333333333 scfalg=auto scfdamp=off scfdiis=on scfdiis_end=50 scfdiis_start=1 scfdiis_step=1 scfdtol=10 scfext=10 scfiguess=sad scflshift=off scfmaxit=50 scftype= scftol=6 spairtol=1e-4 steptol=1e-4 symm=0 talg=occ test=off tprint=off uncontract=off unit=angs verbosity=2 wpairtol=0.100000000E-05 ************************ 2020-06-29 03:12:07 ************************* Executing goldstone... Generation of CC equations in terms of H and T... Generation of antisymmetrized Goldstone diagrams... Number of diagrams in T^1 equations: 8 Translation of diagrams to factorized equations... Optimizing intermediate calculation... Optimizing right-hand EOMCC calculation... Number of floating-point operations per iteration step: 3.9528E+04 Probable CPU time per iteration step (hours): 0.00 Required memory (Mbytes): 6830.0 Number of intermediates: 19 Number of intermediates to be stored: 9 Length of intermediate file (Mbytes): 1.1 ************************ 2020-06-29 03:12:07 ************************* Executing xmrcc... ********************************************************************** CC( 1 ) calculation Allocation of3750.0 Mbytes of memory... Number of spinorbitals: 176 Number of alpha electrons: 5 Number of beta electrons: 0 z-component of spin: 2.5 Spatial symmetry is not used. Convergence criterion: 1.0E-06 Construction of occupation graphs... Number of 0 -fold excitations: 1 Number of 1 -fold excitations: 415 Total number of configurations: 416 Calculation of coupling coefficients... Length of intermediate file (Mbytes): 1.5 ====================================================================== ====================================================================== ====================================================================== ====================================================================== ====================================================================== ====================================================================== ====================================================================== ====================================================================== Memory requirements /Mbyte/: Minimal Optimal Real*8: 5.4362 457.7722 Integer: 0.2606 Total: 5.6969 458.0328 ************************ 2020-06-29 03:12:07 ************************* Executing mrcc... ********************************************************************** LR-CCS calculation OpenMP parallel version is running. Number of CPUs: 16 Allocation of 457.8 Mbytes of memory... Number of spinors: 88 Number of electrons: 5 z-component of spin: 2.5 Spatial symmetry is not used. Convergence criterion: 1.0E-06 Construction of occupation graphs... Number of 0-fold excitations: 1 Number of 1-fold excitations: 415 Total number of determinants: 416 Calculation of coupling coefficients... Initial cluster amplitudes are generated. Length of intermediate file (Mbytes): 1.5 Reading integral list from files MRCONEE and MDCINT... Sorting integrals... Energy of reference determinant [au]: -406.979901063458 Calculation of diagonal elements of Hamiltonian... Calculation of MP denominators... Starting CC iteration... ====================================================================== Norm of residual vector: 0.36537764 CPU time [min]: 0.131 Wall time [min]: 0.023 Iteration 1 CC energy: -406.98398028 Energy decrease: 0.00407921 ====================================================================== Norm of residual vector: 0.02847740 CPU time [min]: 0.140 Wall time [min]: 0.023 Iteration 2 CC energy: -406.98435835 Energy decrease: 0.00037808 ====================================================================== Norm of residual vector: 0.00135263 CPU time [min]: 0.148 Wall time [min]: 0.024 Iteration 3 CC energy: -406.98435848 Energy decrease: 0.00000013 ====================================================================== Norm of residual vector: 0.00127838 CPU time [min]: 0.157 Wall time [min]: 0.024 Iteration 4 CC energy: -406.98437375 Energy decrease: 0.00001527 ====================================================================== Norm of residual vector: 0.00020511 CPU time [min]: 0.165 Wall time [min]: 0.025 Iteration 5 CC energy: -406.98437463 Energy decrease: 0.00000089 ====================================================================== Norm of residual vector: 0.00000626 CPU time [min]: 0.173 Wall time [min]: 0.025 Iteration 6 CC energy: -406.98437464 Energy decrease: 0.00000001 ====================================================================== Norm of residual vector: 0.00000183 CPU time [min]: 0.178 Wall time [min]: 0.025 Iteration 7 CC energy: -406.98437464 Energy decrease: 1.5161E-09 ====================================================================== Norm of residual vector: 0.00000089 CPU time [min]: 0.184 Wall time [min]: 0.026 Iteration 8 CC energy: -406.98437464 Energy decrease: 1.2666E-09 ====================================================================== Iteration has converged in 8 steps. Final results: Total CCS energy [au]: -406.984374638949 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 2 ... ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 1.0000E+00 CPU time [min]: 0.245 Wall time [min]: 0.030 Iteration 1 CI energy: -406.98437464 Energy decrease: 0.0000E+00 ====================================================================== Iteration has converged in 1 steps. Final results: Total LR-CCS energy [au]: -406.984374638949 Excitation energy [eV]: 0.0000 Excitation energy [cm^-1]: 0.00 Absorption wavelength [nm]: Infinity Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 3 ... ====================================================================== Norm of residual vector: 0.74562662 Convergence: 1.00000000 CPU time [min]: 0.254 Wall time [min]: 0.030 Iteration 1 CI energy: -406.85023949 Energy decrease: 0.13413515 ====================================================================== Norm of residual vector: 0.01376515 Convergence: 0.03536600 CPU time [min]: 0.264 Wall time [min]: 0.031 Iteration 2 CI energy: -406.87498239 Energy decrease: 0.02474289 ====================================================================== Norm of residual vector: 0.00274218 Convergence: 0.00395954 CPU time [min]: 0.268 Wall time [min]: 0.031 Iteration 3 CI energy: -406.87499097 Energy decrease: 0.00000859 ====================================================================== Norm of residual vector: 0.00057972 Convergence: 0.00016850 CPU time [min]: 0.273 Wall time [min]: 0.032 Iteration 4 CI energy: -406.87499124 Energy decrease: 0.00000026 ====================================================================== Norm of residual vector: 0.00269138 Convergence: 0.00480129 CPU time [min]: 0.278 Wall time [min]: 0.032 Iteration 5 CI energy: -406.87499360 Energy decrease: 0.00000237 ====================================================================== Norm of residual vector: 0.00006754 Convergence: 0.00012169 CPU time [min]: 0.283 Wall time [min]: 0.032 Iteration 6 CI energy: -406.87499390 Energy decrease: 0.00000029 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 5.8265E-06 CPU time [min]: 0.287 Wall time [min]: 0.033 Iteration 7 CI energy: -406.87499390 Energy decrease: 1.4109E-10 ====================================================================== Iteration has converged in 7 steps. Final results: Total LR-CCS energy [au]: -406.874993898085 Excitation energy [eV]: 2.9764 Excitation energy [cm^-1]: 24006.30 Absorption wavelength [nm]: 416.56 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 4 ... ====================================================================== Norm of residual vector: 0.68282330 Convergence: 1.00000000 CPU time [min]: 0.292 Wall time [min]: 0.033 Iteration 1 CI energy: -406.85023949 Energy decrease: 0.13413515 ====================================================================== Norm of residual vector: 0.01452885 Convergence: 0.03393352 CPU time [min]: 0.297 Wall time [min]: 0.033 Iteration 2 CI energy: -406.87217309 Energy decrease: 0.02193359 ====================================================================== Norm of residual vector: 0.00331228 Convergence: 0.00464402 CPU time [min]: 0.301 Wall time [min]: 0.033 Iteration 3 CI energy: -406.87218308 Energy decrease: 0.00000999 ====================================================================== Norm of residual vector: 0.00075742 Convergence: 0.00019881 CPU time [min]: 0.306 Wall time [min]: 0.034 Iteration 4 CI energy: -406.87218344 Energy decrease: 0.00000036 ====================================================================== Norm of residual vector: 0.00739215 Convergence: 0.00751521 CPU time [min]: 0.311 Wall time [min]: 0.034 Iteration 5 CI energy: -406.87217805 Energy decrease: 0.00000539 ====================================================================== Norm of residual vector: 0.00014015 Convergence: 0.00023845 CPU time [min]: 0.315 Wall time [min]: 0.034 Iteration 6 CI energy: -406.87217981 Energy decrease: 0.00000176 ====================================================================== Norm of residual vector: 0.00021680 Convergence: 0.00037563 CPU time [min]: 0.320 Wall time [min]: 0.035 Iteration 7 CI energy: -406.87217977 Energy decrease: 0.00000003 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 7.5071E-06 CPU time [min]: 0.325 Wall time [min]: 0.035 Iteration 8 CI energy: -406.87217978 Energy decrease: 0.00000001 ====================================================================== Iteration has converged in 8 steps. Final results: Total LR-CCS energy [au]: -406.872179780128 Excitation energy [eV]: 3.0530 Excitation energy [cm^-1]: 24623.93 Absorption wavelength [nm]: 406.11 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 5 ... ====================================================================== Norm of residual vector: 0.70456063 Convergence: 1.00000000 CPU time [min]: 0.332 Wall time [min]: 0.035 Iteration 1 CI energy: -406.85023949 Energy decrease: 0.13413515 ====================================================================== Norm of residual vector: 0.01470916 Convergence: 0.03441405 CPU time [min]: 0.341 Wall time [min]: 0.036 Iteration 2 CI energy: -406.87309370 Energy decrease: 0.02285421 ====================================================================== Norm of residual vector: 0.00320155 Convergence: 0.01274312 CPU time [min]: 0.348 Wall time [min]: 0.036 Iteration 3 CI energy: -406.87310400 Energy decrease: 0.00001030 ====================================================================== Norm of residual vector: 0.00097078 Convergence: 0.00069483 CPU time [min]: 0.352 Wall time [min]: 0.037 Iteration 4 CI energy: -406.87310372 Energy decrease: 0.00000028 ====================================================================== Norm of residual vector: 0.02698854 Convergence: 0.01963582 CPU time [min]: 0.357 Wall time [min]: 0.037 Iteration 5 CI energy: -406.87307722 Energy decrease: 0.00002650 ====================================================================== Norm of residual vector: 0.00020910 Convergence: 0.00027357 CPU time [min]: 0.362 Wall time [min]: 0.037 Iteration 6 CI energy: -406.87310083 Energy decrease: 0.00002361 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 6.8116E-06 CPU time [min]: 0.367 Wall time [min]: 0.038 Iteration 7 CI energy: -406.87310092 Energy decrease: 0.00000009 ====================================================================== Iteration has converged in 7 steps. Final results: Total LR-CCS energy [au]: -406.873100920382 Excitation energy [eV]: 3.0279 Excitation energy [cm^-1]: 24421.76 Absorption wavelength [nm]: 409.47 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 6 ... ====================================================================== Norm of residual vector: 0.72537804 Convergence: 1.00000000 CPU time [min]: 0.371 Wall time [min]: 0.038 Iteration 1 CI energy: -406.85023949 Energy decrease: 0.13413515 ====================================================================== Norm of residual vector: 0.01433110 Convergence: 0.03488947 CPU time [min]: 0.376 Wall time [min]: 0.038 Iteration 2 CI energy: -406.87404277 Energy decrease: 0.02380328 ====================================================================== Norm of residual vector: 0.00688682 Convergence: 0.01276980 CPU time [min]: 0.381 Wall time [min]: 0.038 Iteration 3 CI energy: -406.87403612 Energy decrease: 0.00000666 ====================================================================== Norm of residual vector: 0.00280455 Convergence: 0.00090511 CPU time [min]: 0.386 Wall time [min]: 0.039 Iteration 4 CI energy: -406.87403716 Energy decrease: 0.00000105 ====================================================================== Norm of residual vector: 0.00230067 Convergence: 0.00081513 CPU time [min]: 0.390 Wall time [min]: 0.039 Iteration 5 CI energy: -406.87403754 Energy decrease: 0.00000038 ====================================================================== Norm of residual vector: 0.00327498 Convergence: 0.00023673 CPU time [min]: 0.396 Wall time [min]: 0.039 Iteration 6 CI energy: -406.87403811 Energy decrease: 0.00000057 ====================================================================== Norm of residual vector: 0.00027986 Convergence: 0.00059866 CPU time [min]: 0.401 Wall time [min]: 0.040 Iteration 7 CI energy: -406.87404001 Energy decrease: 0.00000190 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 1.1382E-05 CPU time [min]: 0.405 Wall time [min]: 0.040 Iteration 8 CI energy: -406.87404001 Energy decrease: 0.00000001 ====================================================================== Iteration has converged in 8 steps. Final results: Total LR-CCS energy [au]: -406.874040005022 Excitation energy [eV]: 3.0024 Excitation energy [cm^-1]: 24215.65 Absorption wavelength [nm]: 412.96 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 7 ... ====================================================================== Norm of residual vector: 0.57071693 Convergence: 1.00000000 CPU time [min]: 0.410 Wall time [min]: 0.040 Iteration 1 CI energy: -405.81683713 Energy decrease: 1.16753750 ====================================================================== Norm of residual vector: 0.06853725 Convergence: 0.05660411 CPU time [min]: 0.415 Wall time [min]: 0.041 Iteration 2 CI energy: -405.83234694 Energy decrease: 0.01550981 ====================================================================== Norm of residual vector: 0.00797719 Convergence: 0.01612005 CPU time [min]: 0.419 Wall time [min]: 0.041 Iteration 3 CI energy: -405.83313321 Energy decrease: 0.00078627 ====================================================================== Norm of residual vector: 0.00923071 Convergence: 0.01218757 CPU time [min]: 0.424 Wall time [min]: 0.041 Iteration 4 CI energy: -405.83317502 Energy decrease: 0.00004181 ====================================================================== Norm of residual vector: 0.00109976 Convergence: 0.00168074 CPU time [min]: 0.429 Wall time [min]: 0.041 Iteration 5 CI energy: -405.83318175 Energy decrease: 0.00000674 ====================================================================== Norm of residual vector: 0.00019042 Convergence: 0.00058684 CPU time [min]: 0.434 Wall time [min]: 0.042 Iteration 6 CI energy: -405.83318225 Energy decrease: 0.00000050 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 4.9802E-05 CPU time [min]: 0.439 Wall time [min]: 0.042 Iteration 7 CI energy: -405.83318225 Energy decrease: 2.2817E-09 ====================================================================== Iteration has converged in 7 steps. Final results: Total LR-CCS energy [au]: -405.833182252858 Excitation energy [eV]: 31.3255 Excitation energy [cm^-1]: 252657.54 Absorption wavelength [nm]: 39.58 Spin multiplicity: 2 Starting right-hand LR-CC iteration for root 8 ... ====================================================================== Norm of residual vector: 0.74569178 Convergence: 1.00000000 CPU time [min]: 0.443 Wall time [min]: 0.042 Iteration 1 CI energy: -405.59799610 Energy decrease: 1.38637853 ====================================================================== Norm of residual vector: 0.40142376 Convergence: 0.41499460 CPU time [min]: 0.448 Wall time [min]: 0.043 Iteration 2 CI energy: -405.76106646 Energy decrease: 0.16307035 ====================================================================== Norm of residual vector: 0.01428281 Convergence: 0.02527790 CPU time [min]: 0.452 Wall time [min]: 0.043 Iteration 3 CI energy: -405.76858658 Energy decrease: 0.00752013 ====================================================================== Norm of residual vector: 0.01164735 Convergence: 0.01457642 CPU time [min]: 0.457 Wall time [min]: 0.043 Iteration 4 CI energy: -405.76865556 Energy decrease: 0.00006898 ====================================================================== Norm of residual vector: 0.00659345 Convergence: 0.00586875 CPU time [min]: 0.462 Wall time [min]: 0.043 Iteration 5 CI energy: -405.76868123 Energy decrease: 0.00002566 ====================================================================== Norm of residual vector: 0.00101304 Convergence: 0.00079168 CPU time [min]: 0.467 Wall time [min]: 0.044 Iteration 6 CI energy: -405.76868377 Energy decrease: 0.00000254 ====================================================================== Norm of residual vector: 0.00115398 Convergence: 0.00189848 CPU time [min]: 0.472 Wall time [min]: 0.044 Iteration 7 CI energy: -405.76868529 Energy decrease: 0.00000153 ====================================================================== Norm of residual vector: 0.00002677 Convergence: 0.00004345 CPU time [min]: 0.477 Wall time [min]: 0.044 Iteration 8 CI energy: -405.76868533 Energy decrease: 0.00000003 ====================================================================== Norm of residual vector: 0.0000E+00 Convergence: 1.0982E-06 CPU time [min]: 0.481 Wall time [min]: 0.045 Iteration 9 CI energy: -405.76868533 Energy decrease: 2.9655E-10 ====================================================================== Iteration has converged in 9 steps. Final results: Total LR-CCS energy [au]: -405.768685326011 Excitation energy [eV]: 33.0806 Excitation energy [cm^-1]: 266812.98 Absorption wavelength [nm]: 37.48 Spin multiplicity: 2 ************************ 2020-06-29 03:12:09 ************************* Normal termination of mrcc. ********************************************************************** ********************************************************************** MRCC program system ********************************************************************** Written by Mihaly Kallay, Zoltan Rolik, Jozsef Csontos, Istvan Ladjanszki, Lorant Szegedy, Bence Ladoczki, and Gyula Samu Department of Physical Chemistry and Materials Science Budapest University of Technology and Economics Budapest P.O.Box 91, H-1521 Hungary www.mrcc.hu ************************ 2020-06-29 03:16:26 ************************* Executing minp... Reading input from MINP... Input file: iface=dirac calc=CCSD mem=7500MB symm=0 nstate=4 rest=3 1 3 5 refdet=vector 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Checking keyword combinations... Keywords: active=none agrid=LD0006-LD0302 basis= basopt=off bpcompo=0.985 bpcompv=0.98 calc=ccsd ccprog=mrcc cctol=6 charge=0 cialg=disk ciguess=off cmpgrp=auto core=frozen dboc=off dendec=cholesky dens=0 dfalg=invsqrt dfbasis_cor=none dfbasis_scf=none dfintran=ovirt dft=off diag=david domrad=10.d0 drpaalg=fit ecp=auto edisp=off epert=none eps=0.975 excrad=1e30 excrad_fin=1e30 freq=0.0 gauss=spher geom=zmat gopt=off ghost=none gtol=7 hamilton=dc iface=dirac intalg=auto itol=10 lcorthr=loose lmp2dens=on lnoepso=3e-5 lnoepsv=1e-6 localcc=off maxact=off maxex=0 bfbasis=none mem=7500mb molden=on mult= nacto=0 nactv=0 naf_cor=off naf_scf=off nafalg=albe nchol=auto nstate=4 nsing=0 ntrip=0 occ= optalg= optmaxit=50 opttol=1e-6 orblocc=off orbloco=off orblocv=off osveps=1e-3 ovirt=off ovosnorb=80.0 popul=off qmmm=off refdet=vector rest=3 rgrid=gc rohftype=standard scspe=1.d0 scsps=1.2d0 scspt=0.33333333333333 scfalg=auto scfdamp=off scfdiis=on scfdiis_end=50 scfdiis_start=1 scfdiis_step=1 scfdtol=10 scfext=10 scfiguess=sad scflshift=off scfmaxit=50 scftype= scftol=6 spairtol=1e-4 steptol=1e-4 symm=0 talg=occ test=off tprint=off uncontract=off unit=angs verbosity=2 wpairtol=0.100000000E-05 ************************ 2020-06-29 03:16:26 ************************* Executing goldstone... Generation of CC equations in terms of H and T... Generation of antisymmetrized Goldstone diagrams... Number of diagrams in T^1 equations: 14 Number of diagrams in T^2 equations: 31 Translation of diagrams to factorized equations... Optimizing intermediate calculation... Optimizing right-hand EOMCC calculation... Number of floating-point operations per iteration step: 2.6070E+08 Probable CPU time per iteration step (hours): 0.00 Required memory (Mbytes): 6830.0 Number of intermediates: 84 Number of intermediates to be stored: 36 Length of intermediate file (Mbytes): 242.1 ************************ 2020-06-29 03:16:26 ************************* Executing xmrcc... ********************************************************************** CC( 2 ) calculation Allocation of3750.0 Mbytes of memory... Number of spinorbitals: 176 Number of alpha electrons: 5 Number of beta electrons: 0 z-component of spin: 2.5 Spatial symmetry is not used. Convergence criterion: 1.0E-06 Construction of occupation graphs... Number of 0 -fold excitations: 1 Number of 1 -fold excitations: 415 Number of 2 -fold excitations: 34030 Total number of configurations: 34446 Calculation of coupling coefficients... Length of intermediate file (Mbytes): 125.5 ====================================================================== ====================================================================== ====================================================================== ====================================================================== Memory requirements /Mbyte/: Minimal Optimal Real*8: 351.2644 619.4003 Integer: 0.4458 Total: 351.7102 619.8461 ************************ 2020-06-29 03:16:26 ************************* Executing mrcc... ********************************************************************** LR-CCSD calculation OpenMP parallel version is running. Number of CPUs: 16 Allocation of 619.4 Mbytes of memory... Number of spinors: 88 Number of electrons: 5 z-component of spin: 2.5 Spatial symmetry is not used. Convergence criterion: 1.0E-06 Construction of occupation graphs... Number of 0-fold excitations: 1 Number of 1-fold excitations: 415 Number of 2-fold excitations: 34030 Total number of determinants: 34446 Calculation of coupling coefficients... Initial cluster amplitudes are read from unit 16. Fatal error in mrcc. Program will stop. ************************ 2020-06-29 03:16:26 ************************* Error at the termination of mrcc. **********************************************************************