{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8424735 3.5975957 8.187044 ] [ -10.8584843 3.5231739 -2.7790486 ] [ 10.8526753 -9.035255 -10.9761705 ] [ 7.2082651 -9.4176923 9.4938807 ] [ 3.6400174 11.3321777 -3.9257056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73715576964642e-08 5.763983769118873e-09 1.31170905983299e-08 ] [ -1.739720982611585e-08 5.644746900098653e-09 -4.452526731670412e-09 ] [ 1.738790278204894e-08 -1.447607444323167e-08 -1.758576390590009e-08 ] [ 1.154891391489767e-08 -1.508880654926172e-08 1.521087382352356e-08 ] [ 5.831950825633431e-09 1.815615032327586e-08 -6.28967378428295e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0111543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.123310759682863e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2450977 2.1612175 2.9895775 ] [ 0.2110445 1.1525682 0.735167 ] [ 2.5611997 0.7314735 0.1024236 ] [ 1.9312998 0.432155 2.471926 ] [ 2.0670987 2.7543177 1.4309085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.450977e-11 2.1612175e-10 2.9895775e-10 ] [ 2.110445e-11 1.1525682e-10 7.35167e-11 ] [ 2.5611997e-10 7.314735e-11 1.024236e-11 ] [ 1.9312998e-10 4.32155e-11 2.471926e-10 ] [ 2.0670987e-10 2.7543177e-10 1.4309085e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-05 1.17e-05 1.19e-05 ] [ 3.9e-06 -1.17e-05 -1.33e-05 ] [ -1.12e-05 2.1e-06 4.1e-06 ] [ 8.2e-06 -1.45e-05 -1.2e-06 ] [ 9.1e-06 1.24e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-14 1.87454666178e-14 1.90659019446e-14 ] [ 6.248488872599999e-15 -1.87454666178e-14 -2.13089492322e-14 ] [ -1.79443783008e-14 3.364570931399999e-15 6.568924199399999e-15 ] [ 1.31378483988e-14 -2.3231561193e-14 -1.9226119608e-15 ] [ 1.45798073694e-14 1.98669902616e-14 -2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }