{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.9060266 8.2604982 5.7108237 ] [ 12.147827 -4.6730701 -9.6814244 ] [ -3.7854512 -11.7200895 -6.528728 ] [ 3.5879549 -2.6248664 4.3111276 ] [ -5.165544 -8.5849294 11.0290896 ] [ -3.3944156 4.3844566 -8.5228506 ] [ 7.5156555 14.9580005 3.6819621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.747338084434292e-08 1.323477709220049e-08 9.149748217650552e-09 ] [ 1.9462964412923e-08 -7.487083661579518e-09 -1.551135182972267e-08 ] [ -6.064961411819304e-09 -1.877765339058356e-08 -1.046017536516234e-08 ] [ 5.748537457264802e-09 -4.205499578803462e-09 6.907187850005614e-09 ] [ -8.276113830513714e-09 -1.375457317589857e-08 1.767054950582842e-08 ] [ -5.438453315598804e-09 7.024673859432257e-09 -1.365511197389125e-08 ] [ 1.204140753208694e-08 2.396535869501471e-08 5.899153595291671e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.80745072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.293678666032127e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7002683 4.1975241 3.4657033 ] [ 5.8759569 1.6821014 1.7840115 ] [ 3.4836536 1.3900503 1.5941973 ] [ 5.66127 2.4976515 4.0496644 ] [ 3.267713 1.8480289 4.0222651 ] [ 2.5699438 3.5800157 1.1320102 ] [ 5.0013005 4.8166661 3.8735577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7002683e-10 4.1975241e-10 3.4657033e-10 ] [ 5.8759569e-10 1.6821014e-10 1.7840115e-10 ] [ 3.4836536e-10 1.3900503e-10 1.5941973e-10 ] [ 5.661270000000001e-10 2.4976515e-10 4.0496644e-10 ] [ 3.267713e-10 1.8480289e-10 4.0222651e-10 ] [ 2.5699438e-10 3.5800157e-10 1.1320102e-10 ] [ 5.0013005e-10 4.8166661e-10 3.8735577e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 -2.1e-06 4.5e-06 ] [ -1.7e-05 1.37e-05 -3.73e-05 ] [ -1.8e-06 3e-07 5.6e-06 ] [ 1.26e-05 -1.35e-05 3.33e-05 ] [ -1.52e-05 -2.54e-05 2.7e-05 ] [ 3.96e-05 8.3e-06 -4.3e-06 ] [ -1.02e-05 1.87e-05 -2.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-14 -3.36457090368e-15 7.2097947936e-15 ] [ -2.72370025536e-14 2.194981970496e-14 -5.976118795584e-14 ] [ -2.88391791744e-15 4.8065298624e-16 8.972189076479999e-15 ] [ 2.018742542208e-14 -2.16293843808e-14 5.335248147264001e-14 ] [ -2.435308463616e-14 -4.069528616832e-14 4.32587687616e-14 ] [ 6.344619418368e-14 1.329806595264e-14 -6.889359469440001e-15 ] [ -1.634220153216e-14 2.996070280896e-14 -4.614268667904e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }