{ "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" [ [ -2.9648719 -5.4580046 -13.6069421 ] [ -8.5592733 -2.5877413 7.7004103 ] [ -4.4871998 8.1701222 -5.5467517 ] [ 12.5598762 5.3465667 11.2402736 ] [ 3.4514687 -5.4709431 0.2130099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.750248441846875e-09 -8.744687366338856e-09 -2.180072451319925e-08 ] [ -1.371346757229766e-08 -4.146018611538598e-09 1.233741735322751e-08 ] [ -7.189286612418436e-09 1.308997877791906e-08 -8.886875895122656e-09 ] [ 2.012314000778235e-08 8.566144168287808e-09 1.800890357331545e-08 ] [ 5.529862458562969e-09 -8.765417128547077e-09 3.412794817789459e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 4.5319152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.260928580888157e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7167756 2.9674624 1.5599494 ] [ 1.2733795 1.3127633 4.7337693 ] [ 2.2317056 5.0695778 1.9921944 ] [ 3.1369619 4.2153794 3.8037649 ] [ 2.8793203 0.7572761 3.9629801 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7167756e-10 2.9674624e-10 1.5599494e-10 ] [ 1.2733795e-10 1.3127633e-10 4.733769299999999e-10 ] [ 2.2317056e-10 5.0695778e-10 1.9921944e-10 ] [ 3.1369619e-10 4.2153794e-10 3.8037649e-10 ] [ 2.8793203e-10 7.572761000000001e-11 3.9629801e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1190438 0.0343411 0.2043238 ] [ -0.0121335 0.0041969 0.0058236 ] [ -0.0520352 0.15933 -0.1296108 ] [ -0.0670086 -0.1936711 -0.074713 ] [ 0.0121335 -0.0041969 -0.0058236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.907291932111911e-10 5.502050755255487e-11 3.27362815433015e-10 ] [ -1.94400100284768e-11 6.72417505983552e-12 9.330435768890879e-12 ] [ -8.336958089865215e-11 2.55274800992064e-10 -2.076593935631846e-10 ] [ -1.073596123125389e-10 -3.102953085446189e-10 -1.197034218698304e-10 ] [ 1.94400100284768e-11 -6.72417505983552e-12 -9.330435768890879e-12 ] ] } "relaxed-potential-energy" { "source-value" -19.131952 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.06527662046678e-18 } }