{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.8461218 -8.1109183 -5.3174736 ] [ -6.4634266 9.7610882 3.7835524 ] [ -1.4026999 -4.0422304 3.6570796 ] [ -0.476228 0.0611282 -2.9108216 ] [ 0.8671412 1.5507244 0.7630652 ] [ 1.9850119 -0.7351787 -2.456907 ] [ 1.6440795 1.5153865 2.4815052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.162166428709214e-09 -1.299512367347888e-08 -8.51953188364121e-09 ] [ -1.035555098877683e-08 1.563898730760676e-08 6.06191919885173e-09 ] [ -2.247372985778498e-09 -6.476367042767033e-09 5.859287435524616e-09 ] [ -7.630013677703424e-10 9.793817291158657e-11 -4.663650314839649e-09 ] [ 1.389313357572457e-09 2.484534378984107e-09 1.222565223586076e-09 ] [ 3.180339658189788e-09 -1.177886125250137e-09 -3.936398954879866e-09 ] [ 2.634105737636554e-09 2.427916821775939e-09 3.975809615833628e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.783655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.849255627337303e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5073918 1.3356475 1.9317457 ] [ 1.4729838 3.333273 3.1577514 ] [ 2.4490977 1.4672213 4.4151021 ] [ 2.6452885 3.5660958 1.0364292 ] [ 4.1010225 3.056742 5.1500109 ] [ 4.6049038 1.8628749 3.0886249 ] [ 3.8287298 4.2836284 3.0523817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5073918e-10 1.3356475e-10 1.9317457e-10 ] [ 1.4729838e-10 3.333273e-10 3.1577514e-10 ] [ 2.4490977e-10 1.4672213e-10 4.415102100000001e-10 ] [ 2.6452885e-10 3.5660958e-10 1.0364292e-10 ] [ 4.1010225e-10 3.056742e-10 5.1500109e-10 ] [ 4.6049038e-10 1.8628749e-10 3.0886249e-10 ] [ 3.8287298e-10 4.2836284e-10 3.0523817e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.83e-05 -3.76e-05 7.7e-06 ] [ -2.28e-05 2.33e-05 1.69e-05 ] [ -2e-07 1.17e-05 7.1e-06 ] [ 2.17e-05 5.1e-06 -1.1e-05 ] [ -1.2e-06 -1.74e-05 1.86e-05 ] [ -9.6e-06 1.23e-05 -3.63e-05 ] [ -6.2e-06 2.6e-06 -3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.931983216064e-14 -6.024184094208e-14 1.233675998016e-14 ] [ -3.652962695424e-14 3.733071526464e-14 2.707678489152e-14 ] [ -3.2043532416e-16 1.874546646336e-14 1.137545400768e-14 ] [ 3.476723267136e-14 8.17110076608e-15 -1.76239428288e-14 ] [ -1.92261194496e-15 -2.787787320192e-14 2.980048514688e-14 ] [ -1.538089555968e-14 1.970677243584e-14 -5.815901133504e-14 ] [ -9.93349504896e-15 4.16565921408e-15 -4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.361976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.42256585212907e-18 } }