{ "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" [ [ 2.547532 0.9914533 2.169736 ] [ 2.433953 3.810777 0.6376352 ] [ 4.15783 2.500249 0.4507445 ] [ 3.184718 3.195123 2.789469 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.547532e-10 9.914533000000001e-11 2.169736e-10 ] [ 2.433953e-10 3.810777e-10 6.376352e-11 ] [ 4.15783e-10 2.500249e-10 4.507445e-11 ] [ 3.184718e-10 3.195123e-10 2.789469e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0498003 -2.5227014 -2.9874117 ] [ -12.7271647 10.4057876 -2.5153668 ] [ 10.6260146 -11.6408112 -1.9598562 ] [ 1.0513498 3.757725 7.4626347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68196551102619e-09 -4.041813237639087e-09 -4.786361221878217e-09 ] [ -2.039116589940962e-08 1.667190975108694e-08 -4.03006191289935e-09 ] [ 1.702475230466285e-08 -1.86506357054455e-08 -3.14003580964003e-09 ] [ 1.684448083720573e-09 6.020539191997649e-09 1.19564589444176e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6619999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.387805384349034e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.992212 0.672004 2.314469 ] [ 2.5495429 4.4137987 0.5222187 ] [ 3.8834821 2.1953877 0.418016 ] [ 2.8987961 3.2164119 2.792881 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.992212e-10 6.720040000000001e-11 2.314469e-10 ] [ 2.5495429e-10 4.4137987e-10 5.222187000000001e-11 ] [ 3.8834821e-10 2.1953877e-10 4.18016e-11 ] [ 2.8987961e-10 3.2164119e-10 2.792881e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.58e-05 1.73e-05 4e-07 ] [ -1.54e-05 -2.83e-05 2.37e-05 ] [ 3.78e-05 -2.8e-06 -3.47e-05 ] [ 3.5e-06 1.38e-05 1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.133615715719999e-14 2.77176557682e-14 6.408706536e-16 ] [ -2.46735201636e-14 -4.53415987422e-14 3.79715862258e-14 ] [ 6.056227676519999e-14 -4.486094575199999e-15 -5.55955291998e-14 ] [ 5.607618218999999e-15 2.21100375492e-14 1.69830723204e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.069862 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933805087200451e-18 } }