{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9266032 2.0035132 1.0510167 ] [ 0.5686797 -1.1472479 -1.3548004 ] [ 0.2884509 -1.7801642 -1.3692731 ] [ -0.0397506 0.0560076 -0.0382996 ] [ 0.1082635 -0.3626307 0.1018453 ] [ 0.5167755 -0.6772417 0.537184 ] [ 1.4841841 1.9077636 1.072327 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.688935225398467e-09 3.209982008504195e-09 1.683914384810367e-09 ] [ 9.111253200635577e-10 -1.838093763641896e-09 -2.170629526730489e-09 ] [ 4.621492882287188e-10 -2.852137462425135e-09 -2.193817348310341e-09 ] [ -6.368748198277247e-11 8.973406730711809e-11 -6.136272370599168e-11 ] [ 1.734572485859808e-10 -5.809984295243385e-10 1.631741585983622e-10 ] [ 8.279656243022305e-10 -1.085060818370847e-09 8.606636458678271e-10 ] [ 2.377925065983089e-09 3.056574237933243e-09 1.718057249252602e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.122625085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.301388001162779e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3651167 3.6378878 3.1802886 ] [ 5.2015406 2.1623575 1.9976299 ] [ 2.8966683 1.7084017 1.878595 ] [ 5.9904526 2.4940532 4.1668258 ] [ 3.7279789 1.9381419 4.0669313 ] [ 3.7446071 3.8477852 1.2430704 ] [ 4.6337417 4.2234108 3.3880686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3651167e-10 3.6378878e-10 3.1802886e-10 ] [ 5.201540600000001e-10 2.1623575e-10 1.9976299e-10 ] [ 2.8966683e-10 1.7084017e-10 1.878595e-10 ] [ 5.990452600000001e-10 2.4940532e-10 4.1668258e-10 ] [ 3.7279789e-10 1.9381419e-10 4.066931300000001e-10 ] [ 3.7446071e-10 3.8477852e-10 1.2430704e-10 ] [ 4.6337417e-10 4.2234108e-10 3.3880686e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.28e-05 2.5e-06 -9.7e-06 ] [ 1.1e-06 -2.5e-06 2.8e-06 ] [ 2.6e-06 4e-07 4.7e-06 ] [ -3.5e-06 -2.1e-06 -1.54e-05 ] [ 9.2e-06 7.4e-06 5e-06 ] [ 4.3e-06 9e-07 -1.9e-06 ] [ -9e-07 -6.5e-06 1.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.050786074624e-14 4.005441552e-15 -1.554111322176e-14 ] [ 1.76239428288e-15 -4.005441552e-15 4.48609453824e-15 ] [ 4.16565921408e-15 6.408706483200001e-16 7.53023011776e-15 ] [ -5.6076181728e-15 -3.36457090368e-15 -2.467351996032e-14 ] [ 1.474002491136e-14 1.185610699392e-14 8.010883104e-15 ] [ 6.889359469440001e-15 1.44195895872e-15 -3.04413557952e-15 ] [ -1.44195895872e-15 -1.04141480352e-14 2.32315610016e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }