#
# bug fix restraint torsion
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# numerics after new units converter
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# numerics
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
#numerics parallel bfgs
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# numerics
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# numerics
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# analytic electrostatic in Fist
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
NEB-MIXED.inp
# Numerical noise due to fixing of two single-precision constants 
NEB-MIXED.inp
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# Numerical changes due to new implementation of 14 nonboned terms
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
# numerics after patch 0006
2gly_IT-NEB-CV.inp
2gly_IT-NEB-CV-res.inp
NEB-MIXED.inp
#numerics
2gly_DIIS-SD-2.inp
# Enable Band (NEB) runs using the core-shell model 
2gly_IT-NEB-CV-res.inp
# Bug fix 
2gly_IT-NEB-CV-res.inp
# Numerics 
UO2-2x2x2-CI-NEB-core-shell.inp
UO2-2x2x2-CI-NEB-core-shell-res.inp
# Atomic energy and stress properties 
2gly_IT-NEB-CV.inp
# Atomic energy and stress properties 
2gly_IT-NEB-CV-res.inp
# Atomic energy and stress properties 
UO2-2x2x2-CI-NEB-core-shell.inp
# Atomic energy and stress properties 
UO2-2x2x2-CI-NEB-core-shell-res.inp
# improved BFGS and CELL_OPT, new defaults
2gly_IT-NEB-CV.inp
# improved BFGS and CELL_OPT, new defaults
2gly_IT-NEB-CV-res.inp
