{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0373872 -2.0664999 -0.2397958 ] [ -0.1761346 -0.2582179 1.3658896 ] [ 7.0554726 2.4132092 0.8135644 ] [ 0.6679035 -0.6214791 -0.8292119 ] [ 2.5734688 0.6944911 -2.9244574 ] [ 0.9329462 2.3998297 1.6103566 ] [ -8.0162693 -2.5613331 0.2036547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.866430800250684e-09 -3.310897853943337e-09 -3.841952276913372e-10 ] [ -2.821987405589364e-10 -4.137106858605486e-10 2.188396401743606e-09 ] [ 1.130411334154723e-08 3.866387393193832e-09 1.303473871934229e-09 ] [ 1.070099381466819e-09 -9.957192925393492e-10 -1.328543930814744e-09 ] [ 4.123151579688019e-09 1.112697412940957e-09 -4.685497313408391e-09 ] [ 1.49474460241909e-09 3.84495107091923e-09 2.580075716927684e-09 ] [ -1.284347936431153e-08 -4.103708044710785e-09 3.262908017442798e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.092854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.219230118917343e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4674503 2.3528112 2.46836 ] [ 2.2553675 1.375546 4.6014564 ] [ 2.5688126 4.4956493 2.1777818 ] [ 2.0276397 3.8354199 4.4494363 ] [ 3.7315683 1.2997481 2.6162508 ] [ 4.2917525 2.7823463 4.5973313 ] [ 4.6924771 3.5079152 2.3165044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4674503e-10 2.3528112e-10 2.46836e-10 ] [ 2.2553675e-10 1.375546e-10 4.6014564e-10 ] [ 2.5688126e-10 4.4956493e-10 2.1777818e-10 ] [ 2.0276397e-10 3.8354199e-10 4.449436300000001e-10 ] [ 3.7315683e-10 1.2997481e-10 2.6162508e-10 ] [ 4.2917525e-10 2.7823463e-10 4.5973313e-10 ] [ 4.692477099999999e-10 3.5079152e-10 2.3165044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 6.4e-06 7.5e-06 ] [ 6.9e-06 -5.4e-06 3.2e-06 ] [ -7.8e-06 5.9e-06 -1.1e-06 ] [ -7.5e-06 6.6e-06 -1.6e-06 ] [ 5.9e-06 3e-07 -1.37e-05 ] [ -4.9e-06 8.5e-06 -1.14e-05 ] [ 1.3e-06 -2.23e-05 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.613059803999999e-15 1.02539304576e-14 1.2016324755e-14 ] [ 1.10550187746e-14 -8.6517538236e-15 5.1269652288e-15 ] [ -1.24969777452e-14 9.452842140600001e-15 -1.7623942974e-15 ] [ -1.2016324755e-14 1.05743657844e-14 -2.5634826144e-15 ] [ 9.452842140600001e-15 4.806529901999999e-16 -2.19498198858e-14 ] [ -7.850665506599998e-15 1.3618501389e-14 -1.82648136276e-14 ] [ 2.0828296242e-15 -3.572853893819999e-14 2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043210034805e-18 } }