{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.851272 -4.5046067 -11.9699039 ] [ -5.187197 0.1023402 4.5251268 ] [ -9.262044 11.8280238 13.8682838 ] [ 19.4948038 -17.1565676 4.7748283 ] [ 3.8057091 9.7308104 -11.1983351 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.418130106274166e-08 -7.21717554063904e-09 -1.917790018180274e-08 ] [ -8.310805760883898e-09 1.639670758079962e-10 7.250052365115518e-09 ] [ -1.483943035762091e-08 1.895058320262598e-08 2.221944007497939e-08 ] [ 3.1234118875443e-08 -2.748785150189476e-08 7.65011827059421e-09 ] [ 6.097418145585809e-09 1.55904769243175e-08 -1.794171068910403e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1159401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.594463000833215e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6189666 1.2373325 0.8951675 ] [ 0.2840512 0.4715373 3.1642884 ] [ 0.9876714 2.753884 2.7856987 ] [ 2.5343217 0.8942135 2.3863603 ] [ 2.4765785 2.7854227 0.8805266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.189666000000001e-11 1.2373325e-10 8.951675e-11 ] [ 2.840512e-11 4.715373e-11 3.1642884e-10 ] [ 9.876714e-11 2.753884e-10 2.7856987e-10 ] [ 2.5343217e-10 8.942135e-11 2.3863603e-10 ] [ 2.4765785e-10 2.7854227e-10 8.805266e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-06 4.8e-06 2.7e-06 ] [ 3.18e-05 -1.14e-05 3e-07 ] [ -2.4e-06 2e-06 -5.8e-06 ] [ -4.35e-05 2.32e-05 -9.2e-06 ] [ 1.77e-05 -1.86e-05 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.76783583488e-15 7.69044777984e-15 4.32587687616e-15 ] [ 5.094921654144e-14 -1.826481347712e-14 4.8065298624e-16 ] [ -3.84522388992e-15 3.2043532416e-15 -9.292624400640001e-15 ] [ -6.969468300480001e-14 3.717049760256e-14 -1.474002491136e-14 ] [ 2.835852618816e-14 -2.980048514688e-14 1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }