{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2595242 1.467185 0.6325512 ] [ 0.7762734 2.414106 2.857942 ] [ 1.90158 2.371501 0.3612318 ] [ 2.983554 1.635129 1.622966 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.595242e-11 1.467185e-10 6.325512e-11 ] [ 7.762734e-11 2.414106e-10 2.857942e-10 ] [ 1.90158e-10 2.371501e-10 3.612318e-11 ] [ 2.983554e-10 1.635129e-10 1.622966e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -134.0382345 -75.8922458 26.7194928 ] [ 0.4066617 -1.4668908 0.2309209 ] [ -28.2889667 192.2172662 -223.8900632 ] [ 161.9205395 -114.8581296 196.9396495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.14752925609208e-07 -1.21592781920767e-07 4.280934668379394e-08 ] [ 6.515438683147834e-10 -2.350218145026608e-09 3.699760672340947e-10 ] [ -4.532392107332973e-08 3.0796601001973e-07 -3.587114248884744e-07 ] [ 2.594253028142229e-07 -1.840230099539365e-07 3.155321021374465e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 62.715702 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.004816315014598e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1811965 1.8605773 0.7083827 ] [ 0.8345159 1.771027 3.0273379 ] [ 2.125972 2.1727095 -0.2900105 ] [ 3.1416402 2.0836071 2.0289809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.811965e-11 1.8605773e-10 7.083827000000001e-11 ] [ 8.345159000000001e-11 1.771027e-10 3.0273379e-10 ] [ 2.125972e-10 2.1727095e-10 -2.900105e-11 ] [ 3.1416402e-10 2.0836071e-10 2.0289809e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.32e-05 -3.29e-05 2.24e-05 ] [ -2e-07 3.63e-05 0.0 ] [ -3e-07 3.67e-05 -4.7e-06 ] [ -5.27e-05 -4.02e-05 -1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.523579622656e-14 -5.271161082432e-14 3.588875630592e-14 ] [ -3.2043532416e-16 5.815901133504e-14 0.0 ] [ -4.8065298624e-16 5.879988198335999e-14 -7.53023011776e-15 ] [ -8.443470791616e-14 -6.440750015616e-14 -2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.481807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999805936073779e-18 } }