{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.063375 0.5708417 2.359419 ] [ 2.68579 2.886891 2.868985 ] [ 0.6763911 2.686272 1.583941 ] [ 2.607368 0.7750333 4.497523 ] [ 3.625325 0.6457468 2.38821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.063375e-10 5.708417e-11 2.359419e-10 ] [ 2.68579e-10 2.886891e-10 2.868985e-10 ] [ 6.763911e-11 2.686272e-10 1.583941e-10 ] [ 2.607368e-10 7.750333e-11 4.497523e-10 ] [ 3.625325e-10 6.457468e-11 2.38821e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1799669 -0.9412465 0.1838087 ] [ 0.1249621 0.3005477 -0.052218 ] [ 0.1918851 0.4605002 0.1242523 ] [ -0.5654441 0.1827651 0.4949803 ] [ 0.06863 -0.0025665 -0.7508233 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.883387596978515e-10 -1.508043136709827e-09 2.94494001839641e-10 ] [ 2.002113551060717e-10 4.815304983752122e-10 -8.36624587849344e-11 ] [ 3.074338210998701e-10 7.378026543137241e-10 1.990741301406278e-10 ] [ -9.059413173892973e-10 2.928219703181741e-10 7.930458644165702e-10 ] [ 1.09957381485504e-10 -4.111986297283201e-12 -1.202951537611905e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.074436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.614102582694587e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1354161 0.3054189 2.3605152 ] [ 2.8710621 2.9293444 2.9432545 ] [ 0.788022 2.6055864 1.8216762 ] [ 2.2795479 1.035776 4.4477359 ] [ 3.584201 0.688659 2.1248962 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1354161e-10 3.054189e-11 2.3605152e-10 ] [ 2.8710621e-10 2.9293444e-10 2.9432545e-10 ] [ 7.88022e-11 2.6055864e-10 1.8216762e-10 ] [ 2.2795479e-10 1.035776e-10 4.4477359e-10 ] [ 3.584201e-10 6.88659e-11 2.1248962e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 -1.37e-05 7e-07 ] [ -9e-07 6.5e-06 1.1e-06 ] [ -4.8e-06 1.37e-05 -7.2e-06 ] [ 6.9e-06 -3.7e-06 2.7e-06 ] [ 9.9e-06 -2.8e-06 2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.778416049088e-14 -2.194981970496e-14 1.12152363456e-15 ] [ -1.44195895872e-15 1.04141480352e-14 1.76239428288e-15 ] [ -7.69044777984e-15 2.194981970496e-14 -1.153567166976e-14 ] [ 1.105501868352e-14 -5.928053496960001e-15 4.32587687616e-15 ] [ 1.586154854592e-14 -4.48609453824e-15 4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }