PRIVATEpersonalVASP6.6.1VTST214BBMrepair,notsharedmodule/nativeoriginalsuccess. Original919positivebiasforcehasoppositesignmax.12075eV/A,notqualified. Personal3projection-signchanges+exactRMDSsampleswarmupfix;no publicVASPsource/POTCAR/binary. Actual66checks3x20SCFsteps,matchedexplicitvelocities/RANDOM_SEED,conservativefinitegradient3.18e-12,postchainforce2e-6/time2e-5gatespass;zeroDVMAXcontrol/LBBMloggingexacttrajectories. NVEH2shorttoy notrare-eventstatisticsorphysicaltimecalibration. Readexisting:bash read.sh;bash plot.sh. PersonallicensedmatchedVTSTsourcebuild:bash build-private.sh /your/VASP-VTSTsource;python3 prepare.py;copylicensedHPOTCARtoeachwork-newcase;cd work-new;sbatch ../submit.sh. Readerwork-newsupported. PublicbuildrequiresmatchedoriginalbbmSHAandexistingmakefile.include. Newnativeonlynecessaryfailedalgorithmrepair,notpackagingreplay.
