{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.4460694 -16.9353257 23.707257 ] [ -25.7972812 24.6656218 -11.6317138 ] [ -0.0894296 -3.6696076 -33.2725443 ] [ 9.4116362 -40.7152993 4.3758067 ] [ 40.0498622 11.2116456 -7.3681938 ] [ 3.8712818 25.4429651 24.1893882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.397345072553429e-08 -2.713338290217339e-08 3.798321290869715e-08 ] [ -4.133180081884336e-08 3.951868258545482e-08 -1.863605991019673e-08 ] [ -1.432820143274957e-10 -5.879359504229998e-09 -5.33084925919923e-08 ] [ 1.507910348311495e-08 -6.523310064733461e-08 7.01081519188e-09 ] [ 6.416695288310165e-08 1.796303646101519e-08 -1.180514784388351e-08 ] [ 6.202477192488542e-09 4.076412384705033e-08 3.875567224549539e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 36.783512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.893368295731626e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3862709 0.4359205 2.8336156 ] [ 0.3244571 2.5388229 1.5354761 ] [ 1.4125214 1.2660743 -0.2831504 ] [ 2.409676 -0.1012242 1.5188957 ] [ 3.8039347 1.6122525 2.4343609 ] [ 2.3198652 3.491183 2.446191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.862709e-11 4.359205e-11 2.8336156e-10 ] [ 3.244571e-11 2.5388229e-10 1.5354761e-10 ] [ 1.4125214e-10 1.2660743e-10 -2.831504e-11 ] [ 2.409676e-10 -1.012242e-11 1.5188957e-10 ] [ 3.8039347e-10 1.6122525e-10 2.4343609e-10 ] [ 2.3198652e-10 3.491183e-10 2.446191e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5e-06 2.6e-06 8.5e-06 ] [ -1.57e-05 -6.9e-06 8e-06 ] [ 1.87e-05 5.7e-06 4.5e-06 ] [ -1.82e-05 -6.1e-06 -1.8e-05 ] [ 7.3e-06 9.6e-06 1.27e-05 ] [ 5.4e-06 -4.9e-06 -1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.005441552e-15 4.16565921408e-15 1.36185012768e-14 ] [ -2.515417294656e-14 -1.105501868352e-14 1.28174129664e-14 ] [ 2.996070280896e-14 9.13240673856e-15 7.2097947936e-15 ] [ -2.915961449856e-14 -9.77327738688e-15 -2.88391791744e-14 ] [ 1.169588933184e-14 1.538089555968e-14 2.034764308416e-14 ] [ 8.65175375232e-15 -7.850665441919999e-15 -2.499395528448e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }