{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3489267 6.7069513 2.1303604 ] [ 30.2663095 -27.2325787 -32.9152298 ] [ -27.2326635 -2.0215004 39.631996 ] [ -5.2168486 14.0646036 -21.4082697 ] [ 10.5321293 8.4825242 12.561143 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.337645516751289e-08 1.074572056970417e-08 3.413213626758136e-09 ] [ 4.849197347879694e-08 -4.363140091723606e-08 -5.273601165381945e-08 ] [ -4.36315367818135e-08 -3.238800679817848e-09 6.349745742683911e-08 ] [ -8.35831286117321e-09 2.253397906873951e-08 -3.429982920512103e-08 ] [ 1.687433133170267e-08 1.359050195861022e-08 2.012516964512558e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.1540755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.859915888738071e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4377641 2.9531068 2.1174761 ] [ 2.7316611 0.614424 1.0860283 ] [ 1.2526694 0.8420104 2.9986252 ] [ 1.9165908 2.7254164 0.2047654 ] [ 2.857385 2.6431693 2.4835314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.377641e-11 2.9531068e-10 2.1174761e-10 ] [ 2.7316611e-10 6.14424e-11 1.0860283e-10 ] [ 1.2526694e-10 8.420104000000001e-11 2.9986252e-10 ] [ 1.9165908e-10 2.7254164e-10 2.047654e-11 ] [ 2.857385e-10 2.6431693e-10 2.4835314e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.37e-05 -1.95e-05 -3.14e-05 ] [ -5.53e-05 3.25e-05 -8.9e-06 ] [ 1.8e-05 -2.32e-05 3.56e-05 ] [ 4.35e-05 1.4e-06 2.9e-05 ] [ 7.5e-06 8.9e-06 -2.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.194981970496e-14 -3.12424441056e-14 -5.030834589312e-14 ] [ -8.860036713024e-14 5.207074017599999e-14 -1.425937192512e-14 ] [ 2.88391791744e-14 -3.717049760256e-14 5.703748770048e-14 ] [ 6.969468300480001e-14 2.24304726912e-15 4.64631220032e-14 ] [ 1.2016324656e-14 1.425937192512e-14 -3.909310954752e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786262543259e-18 } }