{ "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" [ [ 1.803671 2.545248 2.102248 ] [ 1.259758 2.236074 4.250707 ] [ 2.077592 4.735817 2.343172 ] [ 2.945146 3.702359 3.858992 ] [ 3.151976 1.102961 3.497539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.803671e-10 2.545248e-10 2.102248e-10 ] [ 1.259758e-10 2.236074e-10 4.250707e-10 ] [ 2.077592e-10 4.735817000000001e-10 2.343172e-10 ] [ 2.945146e-10 3.702359e-10 3.858992e-10 ] [ 3.151976e-10 1.102961e-10 3.497539e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3821528 -5.4345695 -15.3665525 ] [ -12.7490187 -4.6438648 11.7969862 ] [ -2.5444294 15.6025179 -8.0521475 ] [ 11.226132 7.8451616 10.3707758 ] [ 9.4494689 -13.369245 1.250938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.623159385733259e-09 -8.707140197012746e-09 -2.461993115779579e-08 ] [ -2.042617969928201e-08 -7.440291612716068e-09 1.890085548554023e-08 ] [ -4.076625297956171e-09 2.499798940499351e-08 -1.290096247173317e-08 ] [ 1.798624623241475e-08 1.256933450191792e-08 1.661581452631842e-08 ] [ 1.513971815055669e-08 -2.14198917767473e-08 2.004223617670311e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 84.37788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.351882666486679e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1350254 0.3243685 -2.7388158 ] [ -2.3547844 1.426056 7.1443571 ] [ 0.8123278 9.8311304 0.2148252 ] [ 6.6639161 6.073553 7.4008898 ] [ 6.2517089 -3.3326488 4.0314017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.350254e-11 3.243685e-11 -2.7388158e-10 ] [ -2.3547844e-10 1.426056e-10 7.1443571e-10 ] [ 8.123278e-11 9.8311304e-10 2.148252e-11 ] [ 6.6639161e-10 6.073553000000001e-10 7.4008898e-10 ] [ 6.2517089e-10 -3.3326488e-10 4.0314017e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }