{ "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" [ [ -2.7187078 -3.1644988 -2.7088649 ] [ 1.5619577 -3.9545513 0.7951769 ] [ -2.2848213 3.5623182 -2.4712559 ] [ -1.4372449 -1.8759783 0.8267762 ] [ 0.9954421 1.1752158 0.7245463 ] [ 2.1124761 2.1127564 -3.2947591 ] [ 1.7708982 2.144738 6.1283805 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.355850075946602e-09 -5.070085993909655e-09 -4.34008001168573e-09 ] [ 2.50253210961854e-09 -6.335889638614247e-09 1.27401383858022e-09 ] [ -3.660687269565863e-09 5.707462935890338e-09 -3.959388426994063e-09 ] [ -2.302720177144034e-09 -3.005648573388129e-09 1.324641498273865e-09 ] [ 1.594874059980056e-09 1.882903279154769e-09 1.160851142547143e-09 ] [ 3.384559819418763e-09 3.385008909525573e-09 -5.27878600118805e-09 ] [ 2.837291693856803e-09 3.43624908134135e-09 9.818747960466614e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.11624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.06275928056018e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1226431 3.2413384 2.5297392 ] [ 4.7066815 0.9970802 2.0111278 ] [ 3.8394778 2.8637599 0.769849 ] [ 3.4688659 1.7028901 3.946832 ] [ 5.4068176 3.1720635 2.8875403 ] [ 3.8741355 4.9777532 2.0468227 ] [ 3.6053217 4.1357237 4.3512283 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1226431e-10 3.2413384e-10 2.5297392e-10 ] [ 4.7066815e-10 9.970802e-11 2.0111278e-10 ] [ 3.8394778e-10 2.8637599e-10 7.69849e-11 ] [ 3.4688659e-10 1.7028901e-10 3.946832e-10 ] [ 5.4068176e-10 3.1720635e-10 2.8875403e-10 ] [ 3.8741355e-10 4.9777532e-10 2.0468227e-10 ] [ 3.6053217e-10 4.1357237e-10 4.3512283e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.55e-05 1.51e-05 2.2e-06 ] [ 4.47e-05 6.3e-06 6.9e-06 ] [ -2.28e-05 -1.8e-05 1.9e-06 ] [ -1.34e-05 -6.5e-06 -1.03e-05 ] [ 2.09e-05 -2.84e-05 -2.18e-05 ] [ 1.32e-05 1.88e-05 3.9e-06 ] [ -1.71e-05 1.28e-05 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.08555038304e-14 2.419286697408e-14 3.52478856576e-15 ] [ 7.161729494976001e-14 1.009371271104e-14 1.105501868352e-14 ] [ -3.652962695424e-14 -2.88391791744e-14 3.04413557952e-15 ] [ -2.146916671872e-14 -1.04141480352e-14 -1.650241919424e-14 ] [ 3.348549137472e-14 -4.550181603071999e-14 -3.492745033344e-14 ] [ 2.114873139456e-14 3.012092047104e-14 6.24848882112e-15 ] [ -2.739722021568e-14 2.050786074624e-14 2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.602861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.461159883659211e-18 } }