{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.9043551 -14.7834881 -4.2373325 ] [ -24.5036713 -21.5276208 -1.9184642 ] [ -8.3266191 6.9632493 -13.3131059 ] [ 2.0527235 -7.069324 16.7702434 ] [ 8.3373895 -5.0985508 -9.2640797 ] [ 13.5477415 15.180104 1.9918061 ] [ 19.7967911 26.3356304 9.9709328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.747070295005873e-08 -2.368575920283705e-08 -6.788955121988803e-09 ] [ -3.92592096040764e-08 -3.449105103137238e-08 -3.073718514405503e-09 ] [ -1.334071456223811e-08 1.115635532517685e-08 -2.132994719894754e-08 ] [ 3.288825627762698e-09 -1.132630573097541e-08 2.686889212197271e-08 ] [ 1.335797064545694e-08 -8.168778959022006e-09 -1.484269203085373e-08 ] [ 2.170587487477211e-08 2.432120793048993e-08 3.191225192878667e-09 ] [ 3.171795612859916e-08 4.219433166854007e-08 1.597519555134419e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.345006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.29832334277898e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2308203 2.1851192 1.2519853 ] [ 2.6542548 1.4948827 3.7769041 ] [ 1.0832064 4.4375366 1.939922 ] [ 2.1266821 4.0382788 4.3096055 ] [ 4.7825435 1.8432683 2.057672 ] [ 3.7875475 4.3923948 2.059384 ] [ 4.7038704 3.2432726 4.367603 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2308203e-10 2.1851192e-10 1.2519853e-10 ] [ 2.6542548e-10 1.4948827e-10 3.7769041e-10 ] [ 1.0832064e-10 4.4375366e-10 1.939922e-10 ] [ 2.1266821e-10 4.0382788e-10 4.3096055e-10 ] [ 4.7825435e-10 1.8432683e-10 2.057672e-10 ] [ 3.7875475e-10 4.3923948e-10 2.059384e-10 ] [ 4.7038704e-10 3.2432726e-10 4.367603e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 6.9e-06 -1.54e-05 ] [ -1.88e-05 6.18e-05 -1.15e-05 ] [ -2.5e-05 -3.36e-05 3.2e-06 ] [ 3.58e-05 -2.48e-05 7.9e-06 ] [ -2.08e-05 4.43e-05 2.04e-05 ] [ 3.3e-05 -4.91e-05 1.57e-05 ] [ -1.2e-05 -5.5e-06 -2.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 1.10550187746e-14 -2.46735201636e-14 ] [ -3.012092071919999e-14 9.901451598119999e-14 -1.8425031291e-14 ] [ -4.005441585e-14 -5.383313490239999e-14 5.1269652288e-15 ] [ 5.735792349719999e-14 -3.97339805232e-14 1.26571954086e-14 ] [ -3.332527398719999e-14 7.09764248862e-14 3.26844033336e-14 ] [ 5.287182892199999e-14 -7.866687272939998e-14 2.515417315379999e-14 ] [ -1.9226119608e-14 -8.811971486999999e-15 -3.236396800679999e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.952085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.997764755658189e-18 } }