{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3699347 -1.7748514 -1.4510667 ] [ -1.381847 6.3146622 3.5646914 ] [ -1.0404422 2.0036319 -1.919984 ] [ 3.8440433 -5.607832 -6.8963936 ] [ 2.7767842 -7.9931441 3.6291926 ] [ -4.8314078 2.4187096 -1.507038 ] [ 2.0028042 4.6388238 4.5805983 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.194877366445799e-09 -2.843625441902187e-09 -2.324865161115487e-09 ] [ -2.213962975162998e-09 1.011720422844303e-08 5.711265268500747e-09 ] [ -1.666972181867554e-09 3.210172213317024e-09 -3.076153502453856e-09 ] [ 6.158836355344252e-09 -8.984737397797487e-09 -1.104924068478714e-08 ] [ 4.448898762900382e-09 -1.280642870921496e-08 5.814607584005708e-09 ] [ -7.740768686485345e-09 3.875200005551486e-09 -2.414541070150092e-09 ] [ 3.208846091717062e-09 7.432215101603088e-09 7.338927566000121e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5488048 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.529887193318704e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4436387 1.4158564 0.6289045 ] [ 2.7517294 3.5619434 4.4028922 ] [ 1.0370269 3.9111026 1.0493305 ] [ 3.6735866 1.6645182 1.6874434 ] [ 3.1204607 1.1184766 4.055365 ] [ 3.2641662 4.0473497 2.1170626 ] [ 4.8093795 4.1822422 5.5627988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4436387e-10 1.4158564e-10 6.289045e-11 ] [ 2.7517294e-10 3.5619434e-10 4.4028922e-10 ] [ 1.0370269e-10 3.9111026e-10 1.0493305e-10 ] [ 3.6735866e-10 1.6645182e-10 1.6874434e-10 ] [ 3.1204607e-10 1.1184766e-10 4.055365000000001e-10 ] [ 3.2641662e-10 4.0473497e-10 2.1170626e-10 ] [ 4.809379500000001e-10 4.1822422e-10 5.5627988e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.7e-06 -2.08e-05 -2.45e-05 ] [ 2.4e-05 -6.4e-06 3.42e-05 ] [ 2.32e-05 2.87e-05 -5.5e-06 ] [ 7.8e-06 -2.05e-05 -4.2e-06 ] [ 6e-06 -8.4e-06 3.24e-05 ] [ -4.51e-05 3.2e-05 -1.86e-05 ] [ -1.02e-05 -4.7e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.1324068138e-15 -3.332527398719999e-14 -3.925332753299999e-14 ] [ 3.8452239216e-14 -1.02539304576e-14 5.479444088279999e-14 ] [ 3.71704979088e-14 4.598246939579999e-14 -8.811971486999999e-15 ] [ 1.24969777452e-14 -3.2844620997e-14 -6.729141862799999e-15 ] [ 9.613059803999999e-15 -1.34582837256e-14 5.19105229416e-14 ] [ -7.225816619339999e-14 5.126965228799999e-14 -2.98004853924e-14 ] [ -1.63422016668e-14 -7.530230179799999e-15 -2.21100375492e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.011563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.885770538041894e-18 } }