{ "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" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8907738 -0.3305538 -13.4584789 ] [ -8.7735198 3.2344228 12.3389994 ] [ -7.2389187 -1.4695069 -3.0713287 ] [ -1.1612565 -56.1937909 -62.1226249 ] [ 13.4754224 53.8420901 64.0559609 ] [ 6.5890465 0.9173387 2.2574723 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.631530198381174e-09 -5.296055702765991e-10 -2.15628602451101e-08 ] [ -1.405672830568589e-08 5.182116591942474e-09 1.976925636274523e-08 ] [ -1.159802630101193e-08 -2.354409599284284e-09 -4.920811037932057e-09 ] [ -1.860538015052035e-09 -9.00323780141038e-08 -9.953141723750794e-08 ] [ 2.159000672468463e-08 8.626453797322713e-08 1.026289629768589e-07 ] [ 1.055681625566407e-08 1.469738618495065e-09 3.616869341163604e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.5007851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.608876041664991e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0535098 0.113761 0.2943839 ] [ 0.1911796 1.2035761 2.3961636 ] [ -0.0573485 2.5554959 0.4636251 ] [ 2.2794327 0.0934132 1.292087 ] [ 2.3605056 1.2370211 3.3352909 ] [ 2.1638829 2.6389392 1.4684692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.350980000000001e-12 1.13761e-11 2.943839e-11 ] [ 1.911796e-11 1.2035761e-10 2.3961636e-10 ] [ -5.73485e-12 2.5554959e-10 4.636251e-11 ] [ 2.2794327e-10 9.341320000000001e-12 1.292087e-10 ] [ 2.3605056e-10 1.2370211e-10 3.3352909e-10 ] [ 2.1638829e-10 2.6389392e-10 1.4684692e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.83e-05 -7.07e-05 -5.56e-05 ] [ -3.24e-05 4.77e-05 0.0001073 ] [ -1.11e-05 2.2e-05 -1.65e-05 ] [ 9.07e-05 -2.23e-05 -3.94e-05 ] [ -4.54e-05 -8.2e-06 -4.1e-06 ] [ 4.65e-05 3.16e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.738513078464e-14 -1.1327388709056e-13 -8.908102011648e-14 ] [ -5.191052251392001e-14 7.642382481215999e-14 1.7191355141184e-13 ] [ -1.778416049088e-14 3.52478856576e-14 -2.64359142432e-14 ] [ 1.4531741950656e-13 -3.572853864384e-14 -6.312575885952001e-14 ] [ -7.273881858432e-14 -1.313784829056e-14 -6.568924145279999e-15 ] [ 7.45012128672e-14 5.062878121728e-14 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.785631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.131313514077573e-18 } }