{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.881771 -3.0388609 3.0365492 ] [ 0.2452315 3.9548925 -1.1425739 ] [ -4.7194741 -0.3776928 -3.4219124 ] [ 0.6063229 4.6258265 2.9092376 ] [ 3.0636492 -4.4198777 -2.2298425 ] [ 0.8838819 -0.3573756 0.6958427 ] [ 1.8021597 -0.386912 0.1526994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.014929501899437e-09 -4.868791887843247e-09 4.865088136148943e-09 ] [ 3.929041759837152e-10 6.336436301277265e-09 -1.830605190116277e-09 ] [ -7.561431065491122e-09 -6.051305740044902e-10 -5.482508045705618e-09 ] [ 9.714363750356564e-10 7.411391070177091e-09 4.661112467072302e-09 ] [ 4.908507122572624e-09 -7.081424717735276e-09 -3.572601521566224e-09 ] [ 1.416134915728284e-09 -5.725788311643725e-10 1.114862905694348e-09 ] [ 2.887378138287942e-09 -6.199013607069695e-10 2.446514086901876e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.378792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.823083451534608e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3672457 3.404348 3.377824 ] [ 2.5351823 5.6980547 1.3588263 ] [ 1.4190931 3.703995 1.1152423 ] [ 2.5275553 5.4772165 3.6310367 ] [ 3.3863269 2.546195 1.1505528 ] [ 4.5465548 4.6191141 1.4037275 ] [ 3.8524409 3.3816096 3.4453435 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3672457e-10 3.404348e-10 3.377824e-10 ] [ 2.5351823e-10 5.6980547e-10 1.3588263e-10 ] [ 1.4190931e-10 3.703995e-10 1.1152423e-10 ] [ 2.5275553e-10 5.477216500000001e-10 3.6310367e-10 ] [ 3.3863269e-10 2.546195e-10 1.1505528e-10 ] [ 4.5465548e-10 4.6191141e-10 1.4037275e-10 ] [ 3.8524409e-10 3.3816096e-10 3.4453435e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-06 -3.63e-05 9e-06 ] [ -1.4e-06 1.65e-05 -2.58e-05 ] [ -2.2e-05 1.77e-05 1.86e-05 ] [ -1.45e-05 4e-07 -1.04e-05 ] [ -1.06e-05 -5e-07 -8.9e-06 ] [ 4e-05 -1.11e-05 1.49e-05 ] [ 1.74e-05 1.33e-05 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-14 -5.815901133504e-14 1.44195895872e-14 ] [ -2.24304726912e-15 2.64359142432e-14 -4.133615681664e-14 ] [ -3.52478856576e-14 2.835852618816e-14 2.980048514688e-14 ] [ -2.32315610016e-14 6.408706483200001e-16 -1.666263685632e-14 ] [ -1.698307218048e-14 -8.010883104e-16 -1.425937192512e-14 ] [ 6.4087064832e-14 -1.778416049088e-14 2.387243164992e-14 ] [ 2.787787320192e-14 2.130894905664e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }