{ "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" [ [ 2.599025 3.051266 5.123232 ] [ 1.56583 2.880417 3.388537 ] [ 2.27514 4.963397 2.856014 ] [ 3.509207 1.897473 3.301843 ] [ 3.336514 3.219201 1.422465 ] [ 4.208969 3.943636 3.692529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.599025e-10 3.051266e-10 5.123232e-10 ] [ 1.56583e-10 2.880417e-10 3.388537e-10 ] [ 2.27514e-10 4.963397e-10 2.856014e-10 ] [ 3.509207e-10 1.897473e-10 3.301843e-10 ] [ 3.336514e-10 3.219201e-10 1.422465e-10 ] [ 4.208969e-10 3.943636e-10 3.692529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.048216 4.2509849 18.5122928 ] [ -7.4387595 2.4926094 -6.0701116 ] [ 1.6914818 -2.0640616 0.8510555 ] [ 7.0589584 -9.4021557 -12.1876457 ] [ 0.3193592 -1.6420984 1.7780548 ] [ 2.4171761 6.3647214 -2.8836458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.485957031148493e-09 6.810828622153825e-09 2.965996272156417e-08 ] [ -1.19182065586539e-08 3.993600505466316e-09 -9.725390891166882e-09 ] [ 2.710052594468702e-09 -3.306991239411041e-09 1.363541225103254e-09 ] [ 1.130969811567978e-08 -1.506391404766146e-08 -1.952676100313365e-08 ] [ 5.116698438773914e-10 -2.630931665533087e-09 2.84875783106122e-09 ] [ 3.872743035776523e-09 1.019740782498544e-08 -4.620109883428113e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8966576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.447486947582638e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2526304 2.5972601 5.4035463 ] [ 1.2552612 3.3921459 3.6044503 ] [ 2.3902991 5.1018276 2.7931738 ] [ 4.1532105 2.025095 3.0982517 ] [ 3.251604 2.6986828 1.1920319 ] [ 4.1916799 4.1403785 3.693166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2526304e-10 2.597260100000001e-10 5.4035463e-10 ] [ 1.2552612e-10 3.3921459e-10 3.6044503e-10 ] [ 2.3902991e-10 5.1018276e-10 2.7931738e-10 ] [ 4.1532105e-10 2.025095e-10 3.0982517e-10 ] [ 3.251604e-10 2.6986828e-10 1.1920319e-10 ] [ 4.191679899999999e-10 4.1403785e-10 3.693166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.4827646 -0.2533794 -0.1730354 ] [ -0.1039466 -0.2526312 0.6468989 ] [ 1.2574225 0.0729158 0.3523762 ] [ -0.0664108 -0.6624862 -1.0362173 ] [ 0.2328026 -0.7544622 0.3531405 ] [ -0.837103 1.8500431 -0.1431629 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.734741554698636e-10 -4.059585508723315e-10 -2.772332724507763e-10 ] [ -1.665408123316493e-10 -4.04759802324649e-10 1.036446293601237e-09 ] [ 2.014612931967888e-09 1.168239900469287e-10 5.64568909366345e-10 ] [ -1.064018311286247e-10 -1.061419901242633e-09 -1.6602031321285e-09 ] [ 3.729908829814541e-10 -1.208781698117334e-09 5.657934529576224e-10 ] [ -1.341186855801543e-09 2.964095802292357e-09 -2.293722513459283e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.031727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.767477508644812e-18 } }