{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.308038 -2.7921701 -3.1583394 ] [ 1.8056694 -4.1911305 0.6789702 ] [ -2.2930118 3.6248185 -2.2766573 ] [ -1.1913748 -2.4453878 1.081416 ] [ 0.7828939 1.2366883 0.8207486 ] [ 2.0769007 2.2431785 -3.4648668 ] [ 2.1269607 2.324003 6.3187286 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.30006114431799e-09 -4.473549655516798e-09 -5.060217547231499e-09 ] [ 2.893001297573964e-09 -6.714931301821815e-09 1.0878301806599e-09 ] [ -3.673809897178526e-09 5.807599455343326e-09 -3.647607099633652e-09 ] [ -1.908792851170276e-09 -3.917943161949546e-09 1.732619432559053e-09 ] [ 1.254334303146933e-09 1.981393081476897e-09 1.314984218474331e-09 ] [ 3.327561745263154e-09 3.593968148981213e-09 -5.551328581146109e-09 ] [ 3.407766706900403e-09 3.723463273269062e-09 1.012371923610031e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -19.876147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.184509803498406e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2736887 3.1257061 2.5047349 ] [ 4.5305454 0.9910204 1.9876585 ] [ 3.9556221 2.9463577 0.6746501 ] [ 3.5559821 1.6959022 4.092709 ] [ 5.301268 3.1470613 2.8665324 ] [ 3.8392438 5.0172683 2.0467442 ] [ 3.5675929 4.1672929 4.3701102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2736887e-10 3.1257061e-10 2.5047349e-10 ] [ 4.530545400000001e-10 9.910204e-11 1.9876585e-10 ] [ 3.9556221e-10 2.9463577e-10 6.746501e-11 ] [ 3.5559821e-10 1.6959022e-10 4.092709000000001e-10 ] [ 5.301268e-10 3.1470613e-10 2.8665324e-10 ] [ 3.8392438e-10 5.0172683e-10 2.0467442e-10 ] [ 3.5675929e-10 4.1672929e-10 4.3701102e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.53e-05 -4.4e-06 9e-07 ] [ 9.2e-06 1.72e-05 4.2e-06 ] [ -3.4e-06 -8.3e-06 8.5e-06 ] [ -2.5e-06 4.2e-06 -1.09e-05 ] [ -9.85e-05 2e-06 -5.2e-06 ] [ 9.5e-06 -3.3e-06 -7.1e-06 ] [ 2.04e-05 -7.4e-06 9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.0462213333824e-13 -7.04957713152e-15 1.44195895872e-15 ] [ 1.474002491136e-14 2.755743787776e-14 6.72914180736e-15 ] [ -5.44740051072e-15 -1.329806595264e-14 1.36185012768e-14 ] [ -4.005441552e-15 6.72914180736e-15 -1.746372516672e-14 ] [ -1.578143971488e-13 3.2043532416e-15 -8.33131842816e-15 ] [ 1.52206778976e-14 -5.28718284864e-15 -1.137545400768e-14 ] [ 3.268440306432e-14 -1.185610699392e-14 1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551032532881e-18 } }