{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7420484 -18.676475 -59.4692009 ] [ -5.7060172 -16.8541905 49.4534434 ] [ -14.437319 38.6106117 30.1459715 ] [ 27.2941524 -23.1167222 -1.5173043 ] [ 1.9725632 12.7189188 -35.2214043 ] [ 1.6186689 7.3178572 16.6084944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.721065880598205e-08 -2.992301160395568e-08 -9.528016333963831e-08 ] [ -9.142047355722678e-09 -2.700338998160946e-08 7.923315083353605e-08 ] [ -2.313113496883164e-08 6.186101938052695e-08 4.829917074860312e-08 ] [ 4.373005285983221e-08 -3.703707185836835e-08 -2.430989476099309e-09 ] [ 3.160394642090434e-09 2.037795434321359e-08 -5.64309105212046e-08 ] [ 2.593393468396054e-09 1.172449972019295e-08 2.660974143436772e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.647777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.026397261449196e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3223471 0.7948988 0.289093 ] [ 0.8065342 0.081917 2.91475 ] [ 0.43346 2.5840427 2.3116787 ] [ 2.7545761 -0.138556 1.2109265 ] [ 2.5263844 2.3471899 0.4811974 ] [ 2.7175314 3.7546639 2.6446956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.223471e-11 7.948988000000001e-11 2.89093e-11 ] [ 8.065342e-11 8.1917e-12 2.91475e-10 ] [ 4.3346e-11 2.5840427e-10 2.3116787e-10 ] [ 2.7545761e-10 -1.38556e-11 1.2109265e-10 ] [ 2.5263844e-10 2.3471899e-10 4.811974e-11 ] [ 2.7175314e-10 3.7546639e-10 2.6446956e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5e-05 2.47e-05 -1.6e-05 ] [ 0.0 -2.53e-05 1.8e-05 ] [ -7.04e-05 6.7e-06 4.72e-05 ] [ -9e-07 -2.9e-06 1.64e-05 ] [ 2.53e-05 -1.48e-05 -7.56e-05 ] [ 2.11e-05 1.15e-05 1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.005441552e-14 3.957376253376001e-14 -2.56348259328e-14 ] [ 0.0 -4.053506850624e-14 2.88391791744e-14 ] [ -1.1279323410432e-13 1.073458335936e-14 7.562273650176e-14 ] [ -1.44195895872e-15 -4.646312200320001e-15 2.627569658112e-14 ] [ 4.053506850624e-14 -2.371221398784e-14 -1.2112455253248e-13 ] [ 3.380592669888e-14 1.84250311392e-14 1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.562697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.13428957731943e-18 } }