{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3938944 -0.106027 -11.5999621 ] [ -5.4477946 -7.3126912 11.4436679 ] [ 10.1540669 -9.6531831 -4.4275734 ] [ 1.0617748 7.2794593 16.6613532 ] [ 3.379525 -0.863257 -0.4657023 ] [ 0.7637456 9.8660195 -11.921051 ] [ -1.5174233 0.7896796 0.3092678 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.344850147594345e-08 -1.69873981973118e-10 -1.858518823190557e-08 ] [ -8.728329214951377e-09 -1.171622297229742e-08 1.833477731663584e-08 ] [ 1.626860872725281e-08 -1.546610440654368e-08 -7.093754646799935e-09 ] [ 1.701150775130023e-09 1.166297959861399e-08 2.669443078786113e-08 ] [ 5.414595989018849e-09 -1.383090194536938e-09 -7.461373434600582e-10 ] [ 1.22365535464031e-09 1.580710591348836e-08 -1.909962936492233e-08 ] [ -2.431180155147172e-09 1.265206203466466e-09 4.955016428085851e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7615182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.083314647040574e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1067618 1.9568502 1.2944939 ] [ 2.2345387 1.8575192 3.8936897 ] [ 4.0086487 0.7398651 2.3492127 ] [ 4.4023872 3.1847257 4.4602278 ] [ 5.3796545 2.7840386 2.2340287 ] [ 3.4788372 4.0003409 1.1798918 ] [ 2.5005038 4.4017179 3.4055065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1067618e-10 1.9568502e-10 1.2944939e-10 ] [ 2.2345387e-10 1.8575192e-10 3.8936897e-10 ] [ 4.0086487e-10 7.398651000000001e-11 2.3492127e-10 ] [ 4.4023872e-10 3.1847257e-10 4.460227800000001e-10 ] [ 5.379654500000001e-10 2.7840386e-10 2.2340287e-10 ] [ 3.4788372e-10 4.0003409e-10 1.1798918e-10 ] [ 2.5005038e-10 4.401717900000001e-10 3.4055065e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 1.72e-05 -8e-06 ] [ -3.2e-06 -1.63e-05 -2.3e-06 ] [ 1.7e-06 -3.04e-05 1.53e-05 ] [ -4.5e-06 1.22e-05 2.72e-05 ] [ 4.5e-06 1e-05 -3.35e-05 ] [ -1.95e-05 8.7e-06 5.28e-05 ] [ 2.27e-05 -1.4e-06 -5.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.7237002778e-15 2.75574381048e-14 -1.2817413072e-14 ] [ -5.1269652288e-15 -2.61154791342e-14 -3.685006258199999e-15 ] [ 2.7237002778e-15 -4.870616967359999e-14 2.45133025002e-14 ] [ -7.209794853e-15 1.95465549348e-14 4.35792044448e-14 ] [ 7.209794853e-15 1.602176634e-14 -5.367291723899999e-14 ] [ -3.1242444363e-14 1.39389367158e-14 8.45949262752e-14 ] [ 3.636940959179999e-14 -2.2430472876e-15 -8.251209665099998e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.757316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.485906331375434e-18 } }