including the VTST code into the new version of VASP

Vasp transition state theory tools

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hakuna
Posts: 54
Joined: Sat Oct 29, 2005 12:52 am

including the VTST code into the new version of VASP

Post by hakuna »

Dear Professor Graeme:

if we attempt to including VTST code in compiling the new version of VASP 5.4 , should we modify the src/.objects by inserting bfgs.o dynmat.o instanton.o lbfgs.o sd.o cg.o dimer.o bbm.o fire.o lanczos.o neb.o qm.o opt.o both in SOURCE and SOURCE_GPU sections ?
any suggestion is welcome
thank you
sincerly

hakuna
graeme
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Re: including the VTST code into the new version of VASP

Post by graeme »

Yes, that's exactly right.
hakuna
Posts: 54
Joined: Sat Oct 29, 2005 12:52 am

Re: including the VTST code into the new version of VASP

Post by hakuna »

thanks
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