{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5626381 -1.0788394 -0.3650962 ] [ -0.3443095 0.164585 2.9770225 ] [ -2.0338895 1.9091683 -1.7676686 ] [ 0.7151856 -3.8159764 -1.5950057 ] [ 0.9307677 -0.4740654 -1.262728 ] [ -0.7583548 2.489786 1.387122 ] [ 3.0532386 0.8053418 0.6263541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.503622251218155e-09 -1.728491278518579e-09 -5.849486008021908e-10 ] [ -5.516446357642229e-10 2.6369424130689e-10 4.769715888392264e-09 ] [ -3.258650233037943e-09 3.058824840633502e-09 -2.832117327575492e-09 ] [ 1.14585365729327e-09 -6.113868223975437e-09 -2.555480863636813e-09 ] [ 1.491254260621922e-09 -7.595365068678636e-10 -2.023113296697552e-09 ] [ -1.215018340841743e-09 3.989076952860323e-09 2.222414456907348e-09 ] [ 4.891827542946871e-09 1.290299814343501e-09 1.003529903630099e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.320867005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.935326503125909e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0533698 2.3177318 1.658997 ] [ 2.517364 2.7822882 5.0624054 ] [ 1.4101247 3.8429241 3.3211331 ] [ 3.216979 1.2286292 3.3638707 ] [ 3.986893 3.6117108 1.4750871 ] [ 3.2942146 5.1868354 3.1566077 ] [ 4.521887 3.2062864 3.786316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0533698e-10 2.3177318e-10 1.658997e-10 ] [ 2.517364e-10 2.7822882e-10 5.0624054e-10 ] [ 1.4101247e-10 3.8429241e-10 3.3211331e-10 ] [ 3.216979e-10 1.2286292e-10 3.3638707e-10 ] [ 3.986893e-10 3.6117108e-10 1.4750871e-10 ] [ 3.2942146e-10 5.1868354e-10 3.1566077e-10 ] [ 4.521887000000001e-10 3.206286400000001e-10 3.786316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.69e-05 -1.23e-05 -1.73e-05 ] [ -1.4e-05 -1.2e-06 1.66e-05 ] [ 3.81e-05 -1.62e-05 -9.4e-06 ] [ 1.46e-05 2.93e-05 2.5e-06 ] [ 1.99e-05 -2.7e-06 1.49e-05 ] [ -1.87e-05 2.61e-05 3.1e-06 ] [ 7e-06 -2.31e-05 -1.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.514208413459999e-14 -1.97067725982e-14 -2.77176557682e-14 ] [ -2.243047287599999e-14 -1.9226119608e-15 2.65961321244e-14 ] [ 6.10429297554e-14 -2.59552614708e-14 -1.50604603596e-14 ] [ 2.33917788564e-14 4.69437753762e-14 4.005441585e-15 ] [ 3.18833150166e-14 -4.3258769118e-15 2.38724318466e-14 ] [ -2.99607030558e-14 4.18168101474e-14 4.9667475654e-15 ] [ 1.1215236438e-14 -3.70102802454e-14 -1.65024193302e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.807805005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333777898506579e-18 } }