{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7003384 -0.333194 -11.6357353 ] [ -9.8589776 -5.8009444 5.9008569 ] [ -4.1470054 4.319535 0.5867517 ] [ 2.2016537 -8.4683742 -2.7639871 ] [ 8.5404911 3.8636005 -5.1943972 ] [ 1.7806749 -2.1270672 8.1743549 ] [ 5.1835017 8.5464444 4.9321561 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928595673528479e-09 -5.338356369908352e-10 -1.864250306347728e-08 ] [ -1.579582341571089e-08 -9.294137496240684e-09 9.454214967866365e-09 ] [ -6.644235098211353e-09 6.920657989727329e-09 9.400798559546553e-10 ] [ 3.527438085237817e-09 -1.35678311594259e-08 -4.428395511812792e-09 ] [ 1.368337517057048e-08 6.190170393211191e-09 -8.322341752988983e-09 ] [ 2.852955694025378e-09 -3.407937338710518e-09 1.309676031090192e-08 ] [ 8.304885237617056e-09 1.369291340864708e-08 7.902185193556107e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2103928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.54143966694465e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6809245 2.4290112 0.6677921 ] [ 1.5051075 1.1199925 4.1117311 ] [ 1.8885108 3.139033 2.8385895 ] [ 4.8836655 -0.0597138 2.6453907 ] [ 4.9145385 2.0824246 1.5252586 ] [ 3.8614181 0.9100379 4.6098283 ] [ 4.232426 3.1664894 3.6492727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6809245e-10 2.4290112e-10 6.677921e-11 ] [ 1.5051075e-10 1.1199925e-10 4.1117311e-10 ] [ 1.8885108e-10 3.139033e-10 2.8385895e-10 ] [ 4.883665500000001e-10 -5.97138e-12 2.6453907e-10 ] [ 4.9145385e-10 2.0824246e-10 1.5252586e-10 ] [ 3.8614181e-10 9.100379e-11 4.6098283e-10 ] [ 4.232426e-10 3.1664894e-10 3.6492727e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.02e-05 -2.62e-05 -7e-06 ] [ -3.57e-05 -5e-07 -7.5e-06 ] [ -5.8e-06 3.56e-05 -1.5e-06 ] [ -4e-07 -6.2e-06 1.31e-05 ] [ 1.59e-05 2.52e-05 1.28e-05 ] [ 4.15e-05 -1.86e-05 -8.6e-06 ] [ 4.8e-06 -9.4e-06 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.236396774016e-14 -4.197702746496e-14 -1.12152363456e-14 ] [ -5.719770536256001e-14 -8.010883104e-16 -1.2016324656e-14 ] [ -9.292624400640001e-15 5.703748770048e-14 -2.4032649312e-15 ] [ -6.408706483200001e-16 -9.93349504896e-15 2.098851373248e-14 ] [ 2.547460827072e-14 4.037485084416e-14 2.050786074624e-14 ] [ 6.64903297632e-14 -2.980048514688e-14 -1.377871893888e-14 ] [ 7.69044777984e-15 -1.506046023552e-14 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }