{ "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" [ [ 2.966654 1.561504 1.979713 ] [ 1.215751 3.296566 1.975446 ] [ 1.823708 4.192867 4.123573 ] [ 5.205541 2.34853 2.95907 ] [ 3.135824 2.260061 4.318186 ] [ 3.662306 3.63962 2.333021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966654e-10 1.561504e-10 1.979713e-10 ] [ 1.215751e-10 3.296566e-10 1.975446e-10 ] [ 1.823708e-10 4.192867e-10 4.123573e-10 ] [ 5.205541e-10 2.34853e-10 2.95907e-10 ] [ 3.135824e-10 2.260061e-10 4.318186e-10 ] [ 3.662306e-10 3.63962e-10 2.333021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2184429 -27.4572188 -9.342022 ] [ -9.1055619 -0.3086246 -5.9650013 ] [ -3.895062 9.2620699 4.7126197 ] [ 46.4345966 -33.217326 15.8525141 ] [ 0.3242665 -11.5572515 15.1814014 ] [ -25.5397962 63.278351 -20.4395119 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.316739707375975e-08 -4.399131403355023e-08 -1.496756923939926e-08 ] [ -1.458871839542723e-08 -4.944711187237518e-10 -9.556985625901607e-09 ] [ -6.240577272966489e-09 1.483947185399539e-08 7.55044910606151e-09 ] [ 7.439642506879916e-08 -5.322002312269198e-08 2.539852747192235e-08 ] [ 5.195322052086432e-10 -1.851675815400573e-08 2.432328639406039e-08 ] [ -4.091926437163668e-08 1.013830945749763e-07 -3.274770810674339e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1027063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.573260115868872e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8716634 1.375578 2.0541324 ] [ 1.1525962 3.3175498 1.7234739 ] [ 1.5987555 4.1863813 4.1486148 ] [ 5.366165 2.0517362 2.8110435 ] [ 3.3332848 2.2745127 4.5632925 ] [ 3.687319 4.09339 2.3884519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8716634e-10 1.375578e-10 2.0541324e-10 ] [ 1.1525962e-10 3.3175498e-10 1.7234739e-10 ] [ 1.5987555e-10 4.1863813e-10 4.1486148e-10 ] [ 5.366165e-10 2.0517362e-10 2.8110435e-10 ] [ 3.3332848e-10 2.2745127e-10 4.5632925e-10 ] [ 3.687319e-10 4.09339e-10 2.3884519e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.68e-05 -2.46e-05 2.8e-06 ] [ -6.5e-06 1.98e-05 1.13e-05 ] [ -1.24e-05 1.4e-06 -3.9e-06 ] [ -1.37e-05 4.7e-06 -1.51e-05 ] [ -6.3e-06 1.13e-05 -5.4e-06 ] [ 1.22e-05 -1.26e-05 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.293833343744e-14 -3.941354487168e-14 4.48609453824e-15 ] [ -1.04141480352e-14 3.172309709184e-14 1.810459581504e-14 ] [ -1.986699009792e-14 2.24304726912e-15 -6.24848882112e-15 ] [ -2.194981970496e-14 7.53023011776e-15 -2.419286697408e-14 ] [ -1.009371271104e-14 1.810459581504e-14 -8.65175375232e-15 ] [ 1.954655477376e-14 -2.018742542208e-14 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.756188 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.325507915052951e-18 } }