{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7266937 0.3281129 0.1138198 ] [ 0.6755994 0.7068783 2.528749 ] [ 1.24494 2.902842 0.1722514 ] [ 2.894919 0.4231749 1.051303 ] [ 2.63173 1.048668 2.819948 ] [ 2.452649 2.84958 1.823943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.266937e-11 3.281129e-11 1.138198e-11 ] [ 6.755994e-11 7.068783e-11 2.528749e-10 ] [ 1.24494e-10 2.902842e-10 1.722514e-11 ] [ 2.894919e-10 4.231749e-11 1.051303e-10 ] [ 2.63173e-10 1.048668e-10 2.819948e-10 ] [ 2.452649e-10 2.84958e-10 1.823943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5770736 1.9695146 0.9308028 ] [ -8.7380501 -1.9201406 -0.4743839 ] [ -3.4872853 -1.5471931 -4.1702705 ] [ 3.4913309 -6.1970813 -13.4503759 ] [ 5.1793246 0.7966528 15.3632096 ] [ 2.9776064 6.8982476 1.8010179 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.245738304008909e-10 3.155510246444264e-09 1.491310484735178e-09 ] [ -1.39998995815991e-08 -3.076404377968884e-09 -7.600467938639251e-10 ] [ -5.587246977719515e-09 -2.478876612683077e-09 -6.681509897511927e-09 ] [ 5.593728743456622e-09 -9.92881877605687e-09 -2.154987780795176e-08 ] [ 8.298192785654312e-09 1.276378491054858e-09 2.461457524157012e-08 ] [ 4.770651360024453e-09 1.105221102920971e-08 2.885548773022312e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.570259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.013977508720079e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8312266 0.5520473 0.2629598 ] [ 0.427975 0.5406914 2.559244 ] [ 1.1799161 2.818757 0.1029781 ] [ 3.0323755 0.0168213 0.814454 ] [ 2.6704401 1.1137472 2.8396497 ] [ 2.4845978 3.2171919 1.9307286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.312266e-11 5.520473e-11 2.629598e-11 ] [ 4.27975e-11 5.406914000000001e-11 2.559244e-10 ] [ 1.1799161e-10 2.818757e-10 1.029781e-11 ] [ 3.0323755e-10 1.68213e-12 8.144540000000001e-11 ] [ 2.6704401e-10 1.1137472e-10 2.8396497e-10 ] [ 2.4845978e-10 3.2171919e-10 1.9307286e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.43e-05 -9.5e-06 -1.96e-05 ] [ -2.41e-05 -6.9e-06 4.31e-05 ] [ 2.55e-05 -5.4e-06 -2.15e-05 ] [ 9.8e-06 1.74e-05 -3.58e-05 ] [ 6e-06 9.6e-06 2.35e-05 ] [ -2.9e-06 -5.1e-06 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.291112567744e-14 -1.52206778976e-14 -3.140266176767999e-14 ] [ -3.861245656128e-14 -1.105501868352e-14 6.905381235648e-14 ] [ 4.08555038304e-14 -8.65175375232e-15 -3.44467973472e-14 ] [ 1.570133088384e-14 2.787787320192e-14 -5.735792302464001e-14 ] [ 9.6130597248e-15 1.538089555968e-14 3.76511505888e-14 ] [ -4.646312200320001e-15 -8.17110076608e-15 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.486326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961835932168718e-18 } }