{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5099578 -4.2651514 -12.2198456 ] [ 5.8082787 -6.3244584 3.5971412 ] [ -1.5188715 -6.5367221 11.2511589 ] [ -2.3410495 8.8832328 -0.6841049 ] [ 4.5616001 8.2430992 -1.9443497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04301021895546e-08 -6.833525857252389e-09 -1.957835093010575e-08 ] [ 9.305888340230616e-09 -1.013289938770217e-08 5.763255532356456e-09 ] [ -2.433500407299427e-09 -1.047298332528668e-08 1.802634374648585e-08 ] [ -3.75077477703553e-09 1.423250790928372e-08 -1.096056876954722e-09 ] [ 7.308489033658942e-09 1.320690082117518e-08 -3.115191631999494e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3656546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.994549734607976e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8927778 2.0927992 0.945593 ] [ 3.0302078 1.4547932 2.4023283 ] [ 0.8338267 1.9639471 3.5659565 ] [ 0.5320919 4.2384905 2.4830052 ] [ 2.8147077 3.8025111 1.464696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.927778e-11 2.0927992e-10 9.45593e-11 ] [ 3.0302078e-10 1.4547932e-10 2.402328300000001e-10 ] [ 8.338267e-11 1.9639471e-10 3.5659565e-10 ] [ 5.320918999999999e-11 4.2384905e-10 2.4830052e-10 ] [ 2.8147077e-10 3.8025111e-10 1.464696e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.8e-06 1.5e-06 -4.8e-06 ] [ 8.8e-06 2.04e-05 -2.4e-06 ] [ -1.01e-05 1.83e-05 -1.36e-05 ] [ 8.8e-06 -9.4e-06 1.94e-05 ] [ -1.63e-05 -3.08e-05 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.409915426304e-14 2.4032649312e-15 -7.69044777984e-15 ] [ 1.409915426304e-14 3.268440306432e-14 -3.84522388992e-15 ] [ -1.618198387008e-14 2.931983216064e-14 -2.178960204288e-14 ] [ 1.409915426304e-14 -1.506046023552e-14 3.108222644352e-14 ] [ -2.611547891904e-14 -4.934703992064001e-14 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.43983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672645155112647e-18 } }