{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1909735 1.2731009 2.1006598 ] [ 1.1923668 -1.711664 -0.8317054 ] [ -2.647721 2.4538736 -0.3280118 ] [ 3.8651788 -1.1816905 -1.7299448 ] [ 0.341113 -0.9938443 1.6438645 ] [ 0.1532956 0.6752999 -2.8873538 ] [ -0.7132597 -0.5150756 2.0324915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.510326547413199e-09 2.03973251470437e-09 3.365628047543113e-09 ] [ 1.910382226117351e-09 -2.742388066058976e-09 -1.332538958251624e-09 ] [ -4.242116719551114e-09 3.931538944709462e-09 -5.255328416362812e-10 ] [ 6.192699159592158e-09 -1.893276907719777e-09 -2.771677136669803e-09 ] [ 5.46523278153642e-10 -1.592314115294086e-09 2.633761291362093e-09 ] [ 2.456066284150104e-10 1.081949720722536e-09 -4.626050792451109e-09 ] [ -1.14276802531385e-09 -8.252420910635302e-10 3.25641039010361e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.248675064916391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.282889425446747e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.82416 3.1388995 4.3154609 ] [ 1.3943348 4.1978648 2.8636569 ] [ 3.2341625 3.8603569 1.5074818 ] [ 4.5323253 1.9760679 2.1478672 ] [ 4.8285365 1.9725657 4.5824485 ] [ 5.5721953 4.4730041 1.2328125 ] [ 5.3882045 4.4398892 3.5736873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.82416e-10 3.1388995e-10 4.3154609e-10 ] [ 1.3943348e-10 4.1978648e-10 2.8636569e-10 ] [ 3.2341625e-10 3.8603569e-10 1.5074818e-10 ] [ 4.5323253e-10 1.9760679e-10 2.1478672e-10 ] [ 4.828536500000001e-10 1.9725657e-10 4.5824485e-10 ] [ 5.5721953e-10 4.4730041e-10 1.2328125e-10 ] [ 5.388204499999999e-10 4.4398892e-10 3.5736873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.52e-05 4.04e-05 7.75e-05 ] [ 3.34e-05 -2.87e-05 -1.46e-05 ] [ 1.04e-05 2.7e-06 -6.99e-05 ] [ -2.37e-05 2.02e-05 -6.26e-05 ] [ 2.53e-05 4.16e-05 -3e-07 ] [ -2.56e-05 -1.89e-05 0.0001156 ] [ -3.5e-05 -5.73e-05 -4.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.43530848368e-14 6.472793601359999e-14 1.24168689135e-13 ] [ 5.351269957559999e-14 -4.598246939579999e-14 -2.33917788564e-14 ] [ 1.66626369936e-14 4.3258769118e-15 -1.119921467166e-13 ] [ -3.79715862258e-14 3.236396800679999e-14 -1.002962572884e-13 ] [ 4.053506884019999e-14 6.665054797439999e-14 -4.806529901999999e-16 ] [ -4.10157218304e-14 -3.02811383826e-14 1.852116188904e-13 ] [ -5.607618218999999e-14 -9.180472112819998e-14 -7.32194721738e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.458504064916394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.797160727740306e-18 } }