{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2813551 -2.8596791 -0.0710749 ] [ 1.8828027 -1.673311 -1.495664 ] [ 1.1692568 -4.6490481 1.4441266 ] [ 2.825976 3.5270538 0.1477636 ] [ -2.2265169 0.2146774 -5.5313737 ] [ 2.4686446 0.7167394 4.0089749 ] [ -1.8388081 4.7235675 1.4972475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.859487046562846e-09 -4.581710997010385e-09 -1.138745431056979e-10 ] [ 3.016582467519117e-09 -2.680939763527469e-09 -2.396317893372212e-09 ] [ 1.873355908671421e-09 -7.44859617479466e-09 2.313745875995393e-09 ] [ 4.527712678141901e-09 5.650963138663799e-09 2.367433853252429e-10 ] [ -3.567273322996092e-09 3.439511112941299e-10 -8.862237623047993e-09 ] [ 3.955204663184168e-09 1.14834310988622e-09 6.423085858154019e-09 ] [ -2.946095347957668e-09 7.567989415270704e-09 2.398854940051248e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.482964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.320426632068805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3260791 2.3657272 2.7257776 ] [ 5.3810162 2.3233815 1.4921381 ] [ 4.3756659 1.6369579 3.4261954 ] [ 6.0291425 4.244376 2.5998155 ] [ 3.285775 2.8671993 0.6850034 ] [ 4.8245184 3.6199514 4.4696364 ] [ 2.6747118 4.2908617 3.9544165 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3260791e-10 2.3657272e-10 2.7257776e-10 ] [ 5.3810162e-10 2.3233815e-10 1.4921381e-10 ] [ 4.375665900000001e-10 1.6369579e-10 3.4261954e-10 ] [ 6.0291425e-10 4.244376e-10 2.5998155e-10 ] [ 3.285775e-10 2.8671993e-10 6.850034000000001e-11 ] [ 4.8245184e-10 3.6199514e-10 4.4696364e-10 ] [ 2.6747118e-10 4.2908617e-10 3.9544165e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 -9.2e-06 -2.2e-06 ] [ 2.7e-06 1.6e-06 -1.6e-05 ] [ 3.3e-06 1.26e-05 4.3e-06 ] [ -1.58e-05 -5.6e-06 1.61e-05 ] [ -3.3e-06 -2e-06 6.9e-06 ] [ 1.49e-05 -1.01e-05 5.5e-06 ] [ 1.1e-06 1.28e-05 -1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 -1.474002491136e-14 -3.52478856576e-15 ] [ 4.32587687616e-15 2.56348259328e-15 -2.56348259328e-14 ] [ 5.28718284864e-15 2.018742542208e-14 6.889359469440001e-15 ] [ -2.531439060864e-14 -8.972189076479999e-15 2.579504359488e-14 ] [ -5.28718284864e-15 -3.2043532416e-15 1.105501868352e-14 ] [ 2.387243164992e-14 -1.618198387008e-14 8.8119714144e-15 ] [ 1.76239428288e-15 2.050786074624e-14 -2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }