{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.902564 -4.4017653 2.2991235 ] [ 5.3504927 -4.5088836 -3.4227 ] [ 11.1084925 -14.5940959 21.0802455 ] [ -7.281654 15.3784581 -17.5608629 ] [ -3.2747673 8.1262867 -2.3958062 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.456950121489575e-09 -7.052405512011999e-09 3.683601950380298e-09 ] [ 8.572434384327571e-09 -7.224027949345802e-09 -5.483769965191799e-09 ] [ 1.779776712246425e-08 -2.33823194453352e-08 3.377427677908364e-08 ] [ -1.166649589567263e-08 2.463900623476803e-08 -2.813560421125748e-08 ] [ -5.246755649847268e-09 1.301974667192497e-08 -3.83850471323233e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.66813207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.070465590980052e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7147605 -0.0564099 1.738361 ] [ 2.7776952 0.4111102 -0.3687632 ] [ 2.0012493 0.984184 3.7395557 ] [ 1.2452245 2.0981708 0.6471066 ] [ 2.1481594 2.9408266 2.2011984 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.147605e-11 -5.64099e-12 1.738361e-10 ] [ 2.7776952e-10 4.111102e-11 -3.687632e-11 ] [ 2.0012493e-10 9.84184e-11 3.7395557e-10 ] [ 1.2452245e-10 2.0981708e-10 6.471066e-11 ] [ 2.1481594e-10 2.9408266e-10 2.2011984e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.29e-05 -1.65e-05 -1.18e-05 ] [ -4.75e-05 2.31e-05 3.53e-05 ] [ -1.04e-05 1.8e-06 -6.1e-06 ] [ 4.61e-05 5.3e-06 1.8e-05 ] [ -1.11e-05 -1.36e-05 -3.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.66898449186e-14 -2.6435914461e-14 -1.89056842812e-14 ] [ -7.6103390115e-14 3.70102802454e-14 5.655683518019999e-14 ] [ -1.66626369936e-14 2.8839179412e-15 -9.773277467399999e-15 ] [ 7.386034282739999e-14 8.4915361602e-15 2.8839179412e-14 ] [ -1.77841606374e-14 -2.17896022224e-14 -5.671705284359999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.351186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.818660497738792e-18 } }