{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1075336 -2.6755859 -1.6813629 ] [ -3.6310824 3.9618081 -1.3338229 ] [ -0.0441562 -2.166964 -3.3557591 ] [ 2.2500954 -3.0086492 -2.6014926 ] [ 2.0704765 -4.5660774 3.1565917 ] [ 1.6245864 2.9267894 -2.031074 ] [ 1.8376138 5.528679 7.8469199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.580994303070459e-09 -4.286761175922127e-09 -2.693840329460488e-09 ] [ -5.817635329478354e-09 6.347516313916068e-09 -2.137019866667656e-09 ] [ -7.074603130336896e-11 -3.471859058915252e-09 -5.37651877505685e-09 ] [ 3.605050244449625e-09 -4.820387408428623e-09 -4.168050622904206e-09 ] [ 3.317269042215811e-09 -7.31566245904325e-09 5.057417423151327e-09 ] [ 2.602874348549637e-09 4.689233550685259e-09 -3.254139277914739e-09 ] [ 2.944181868419447e-09 8.857920237707925e-09 1.257215160907027e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.907952 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.34982318832086e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0799766 2.1966876 3.5634401 ] [ 2.0415722 4.7238849 3.0291214 ] [ 2.8681236 3.0806611 1.2675562 ] [ 4.7445002 2.1995414 2.8091566 ] [ 3.9488995 1.5115739 5.0794628 ] [ 4.4921325 4.7265033 2.3354013 ] [ 3.8457724 3.9862388 4.7245256 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0799766e-10 2.1966876e-10 3.563440100000001e-10 ] [ 2.0415722e-10 4.7238849e-10 3.0291214e-10 ] [ 2.8681236e-10 3.0806611e-10 1.2675562e-10 ] [ 4.7445002e-10 2.1995414e-10 2.8091566e-10 ] [ 3.9488995e-10 1.5115739e-10 5.079462800000001e-10 ] [ 4.4921325e-10 4.7265033e-10 2.3354013e-10 ] [ 3.8457724e-10 3.9862388e-10 4.7245256e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -2.9e-06 2.29e-05 ] [ -3.31e-05 1.59e-05 -3.2e-06 ] [ 6.8e-06 -1.29e-05 -3.5e-05 ] [ 9.7e-06 -2.14e-05 -6.2e-06 ] [ -1.02e-05 1.5e-05 -6.2e-06 ] [ 8.5e-06 2.28e-05 -2.3e-06 ] [ 1.98e-05 -1.65e-05 3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 -4.646312200320001e-15 3.668984461632e-14 ] [ -5.303204614848e-14 2.547460827072e-14 -5.126965186560001e-15 ] [ 1.089480102144e-14 -2.066807840832e-14 -5.6076181728e-14 ] [ 1.554111322176e-14 -3.428657968511999e-14 -9.93349504896e-15 ] [ -1.634220153216e-14 2.4032649312e-14 -9.93349504896e-15 ] [ 1.36185012768e-14 3.652962695424e-14 -3.68500622784e-15 ] [ 3.172309709184e-14 -2.64359142432e-14 4.8065298624e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }