{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3816117 2.148684 2.733224 ] [ 2.712897 0.4244761 0.4772031 ] [ 2.541656 0.3986681 2.603311 ] [ 2.733268 2.696855 1.756122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.816117e-11 2.148684e-10 2.733224e-10 ] [ 2.712897e-10 4.244761e-11 4.772031e-11 ] [ 2.541656e-10 3.986681000000001e-11 2.603311e-10 ] [ 2.733268e-10 2.696855e-10 1.756122e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3460458 1.126323 0.937326 ] [ 0.9953295 -4.0924861 -7.9602544 ] [ 0.1788556 -6.1508754 7.1584095 ] [ 1.1718608 9.1170385 -0.1354811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.758779732086032e-09 1.804568378069318e-09 1.501761803267981e-09 ] [ 1.594693654892554e-09 -6.556885550368971e-09 -1.275373349530033e-08 ] [ 2.865582608191565e-10 -9.85478876333385e-09 1.146903634301262e-08 ] [ 1.877527976591985e-09 1.46071059356335e-08 -2.170646509802669e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5335705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.059227422248567e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.034698 2.1147484 3.0613436 ] [ 3.150032 0.7195976 0.7235976 ] [ 1.8777051 -0.1300312 2.621593 ] [ 2.3069976 2.9643684 1.1633259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.034698e-10 2.1147484e-10 3.0613436e-10 ] [ 3.150032e-10 7.195975999999999e-11 7.235976e-11 ] [ 1.8777051e-10 -1.300312e-11 2.621593e-10 ] [ 2.3069976e-10 2.9643684e-10 1.1633259e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.84e-05 -7.2e-06 -7.4e-06 ] [ -6.5e-06 -1.67e-05 -2e-05 ] [ 1.23e-05 6.7e-06 1.55e-05 ] [ 1.26e-05 1.73e-05 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.948004982272e-14 -1.153567166976e-14 -1.185610699392e-14 ] [ -1.04141480352e-14 -2.675634956736e-14 -3.2043532416e-14 ] [ 1.970677243584e-14 1.073458335936e-14 2.48337376224e-14 ] [ 2.018742542208e-14 2.771765553984e-14 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.104631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298505030841092e-18 } }