X-Git-Url: https://hackdaworld.org/gitweb/?p=lectures%2Flatex.git;a=blobdiff_plain;f=posic%2Fthesis%2Fbasics.tex;h=4568141107a7277e339c94f5f9ab0fdb5bf5895e;hp=ba62d82ca738adf57a3e6e1a7750cb8da6d57d94;hb=06b5a10c4be0574aa9b45f7068ac8157dcb1815c;hpb=80e31ff7bd5a85d056283bc94f433c822c53fd34 diff --git a/posic/thesis/basics.tex b/posic/thesis/basics.tex index ba62d82..4568141 100644 --- a/posic/thesis/basics.tex +++ b/posic/thesis/basics.tex @@ -669,7 +669,7 @@ In the modified version respective energies could be higher than the real ones d Structures of maximum configurational energy do not necessarily constitute saddle point configurations, i .e. the method does not guarantee to find the true minimum energy path. Whether a saddle point configuration and, thus, the minimum energy path is obtained by the CRT method, needs to be verified by caculating the respective vibrational modes. -Modifications used to add the CRT feature to the VASP code and a short instruction on how to use it can be found in appendix \ref{app:patch_vasp}. +Modifications used to add the CRT feature to the {\textsc vasp} code and a short instruction on how to use it can be found in appendix \ref{app:patch_vasp}. % todo - advantages of pw basis concenring hf forces