{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2471124 6.4136869 4.8549592 ] [ 3.8215652 3.6815957 -3.7008642 ] [ -3.1409209 -0.5607428 -5.7535416 ] [ 7.4286196 -3.2411733 2.6623788 ] [ -4.6038129 1.0869595 1.9327443 ] [ -0.1758586 -1.6710575 -1.1351177 ] [ -3.08248 -5.7092684 1.1394412 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.95917709989778e-10 1.027585920431123e-08 7.77850212517787e-09 ] [ 6.122822418302877e-09 5.898566557777811e-09 -5.929438097995695e-09 ] [ -5.032310033762094e-09 -8.984090044419302e-10 -9.218189838320225e-09 ] [ 1.190196064793665e-08 -5.192932085221185e-09 4.265601069073559e-09 ] [ -7.376121394917448e-09 1.741501098656458e-09 3.096597731444462e-09 ] [ -2.817565374866189e-10 -2.677329258512496e-09 -1.818659040796268e-09 ] [ -4.938677390083584e-09 -9.147256352352224e-09 1.825586051416297e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.289723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.173383928270804e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4884356 1.2654979 2.7596393 ] [ 1.6102193 1.7802844 4.7361117 ] [ 2.2757965 3.8332739 5.2699181 ] [ 1.8139482 3.3241544 3.1741367 ] [ 3.69678 3.0003343 2.0719182 ] [ 3.6406913 2.4625251 4.2102402 ] [ 3.5653621 4.587307 3.6233568 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4884356e-10 1.2654979e-10 2.7596393e-10 ] [ 1.6102193e-10 1.7802844e-10 4.7361117e-10 ] [ 2.2757965e-10 3.8332739e-10 5.269918100000001e-10 ] [ 1.8139482e-10 3.3241544e-10 3.1741367e-10 ] [ 3.69678e-10 3.0003343e-10 2.0719182e-10 ] [ 3.6406913e-10 2.4625251e-10 4.2102402e-10 ] [ 3.5653621e-10 4.587307e-10 3.6233568e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.68e-05 5.8e-05 3.15e-05 ] [ 3.17e-05 -2.11e-05 -1.99e-05 ] [ 8.2e-06 1.37e-05 1.68e-05 ] [ -5.62e-05 -3e-05 2.9e-05 ] [ 4.35e-05 -9e-07 -1.22e-05 ] [ -9.06e-05 -4.12e-05 -8.6e-06 ] [ 3.67e-05 2.15e-05 -3.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.293833343744e-14 9.29262440064e-14 5.04685635552e-14 ] [ 5.078899887936e-14 -3.380592669888e-14 -3.188331475392e-14 ] [ 1.313784829056e-14 2.194981970496e-14 2.691656722944e-14 ] [ -9.004232608896e-14 -4.8065298624e-14 4.64631220032e-14 ] [ 6.969468300480001e-14 -1.44195895872e-15 -1.954655477376e-14 ] [ -1.4515720184448e-13 -6.600967677696001e-14 -1.377871893888e-14 ] [ 5.879988198335999e-14 3.44467973472e-14 -5.863966432128e-14 ] ] } "relaxed-potential-energy" { "source-value" -52.328123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.383889528094676e-18 } }