{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.4564177 -9.2842243 -14.7571651 ] [ 1.1103655 -0.7100391 0.7380528 ] [ 23.0420798 -9.5912848 1.4501996 ] [ -15.3149485 14.8545874 13.9906944 ] [ 3.6189209 4.7309608 -1.4217817 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.995738121785931e-08 -1.487496711572325e-08 -2.364358491250569e-08 ] [ 1.779001644642902e-09 -1.137608045873874e-09 1.182490941075978e-09 ] [ 3.691748155016795e-08 -1.53669322699944e-08 2.323475894613512e-09 ] [ -2.453725243545603e-08 2.379967264391026e-08 2.241556347643748e-08 ] [ 5.798150458504495e-09 7.579834787681265e-09 -2.27794539962128e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.903243224591099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.855861660535864e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1581866 0.2708921 1.3366388 ] [ 0.9587262 2.6123774 1.2010673 ] [ 3.168686 0.5117234 2.5368941 ] [ 1.17353 1.5723741 3.3579012 ] [ 2.9691518 2.8532079 2.4014436 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1581866e-10 2.708921e-11 1.3366388e-10 ] [ 9.587262e-11 2.6123774e-10 1.2010673e-10 ] [ 3.168686e-10 5.117234000000001e-11 2.5368941e-10 ] [ 1.17353e-10 1.5723741e-10 3.3579012e-10 ] [ 2.9691518e-10 2.8532079e-10 2.4014436e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.11e-05 1.21e-05 -9.4e-06 ] [ -1.61e-05 -1.8e-06 1.76e-05 ] [ -1.56e-05 -9.4e-06 1.8e-05 ] [ 1.15e-05 4.7e-06 -1.14e-05 ] [ -8e-07 -5.7e-06 -1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.380592669888e-14 1.938633711168e-14 -1.506046023552e-14 ] [ -2.579504359488e-14 -2.88391791744e-15 2.819830852608e-14 ] [ -2.499395528448e-14 -1.506046023552e-14 2.88391791744e-14 ] [ 1.84250311392e-14 7.53023011776e-15 -1.826481347712e-14 ] [ -1.28174129664e-15 -9.13240673856e-15 -2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }