Patrick SK Pang
pangsiukwong@gmail.com
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SOLVING THE COUPLED-PERTURBED KOHN-SHAM EQUATIONS IN THE
ATOMIC-ORBITAL BASIS
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..... 50 ITERATIONS CARRIED OUT .....
FATAL: TOO MANY ITERATIONS IN CPKS!
ADDRESS 0x0067C2DB HAS INITIATED PROGRAM ABORT BECAUSE OF FATAL ERROR(S)
Please advise!