{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6697266 -2.8546226 -10.1737712 ] [ -2.6161046 -3.838132 6.6389548 ] [ 4.8366411 -4.7958798 -2.4622641 ] [ 4.4717216 12.5545779 9.8358507 ] [ -2.1241864 3.7361955 2.9121833 ] [ 0.6946748 5.2124364 -5.0484991 ] [ 2.40698 -10.0145754 -1.7024544 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.228825674768826e-08 -4.573609628608327e-09 -1.630017849630214e-08 ] [ -4.191461662219916e-09 -6.149365408607687e-09 1.063677825474214e-08 ] [ 7.749153357464056e-09 -7.683846555032591e-09 -3.944982007757039e-09 ] [ 7.164487861273094e-09 2.011465136111279e-08 1.575877016705254e-08 ] [ -3.403321816340577e-09 5.986045130155946e-09 4.665832037185012e-09 ] [ 1.112991732788623e-09 8.351243806291077e-09 -8.088587294790029e-09 ] [ 3.856407114505319e-09 -1.60451187053112e-08 -2.727632660130489e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2646725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.484364180116236e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.812403 1.7477549 1.0314547 ] [ 3.0703277 0.5458434 2.6402552 ] [ 3.221239 0.8080909 5.1205227 ] [ 3.6778705 2.7678834 3.6450236 ] [ 4.3488841 5.1245272 1.3987624 ] [ 2.3766219 3.8769226 1.8791188 ] [ 5.6039859 4.0540353 3.1019137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.812403e-10 1.7477549e-10 1.0314547e-10 ] [ 3.0703277e-10 5.458434e-11 2.6402552e-10 ] [ 3.221239e-10 8.080909e-11 5.120522700000001e-10 ] [ 3.6778705e-10 2.7678834e-10 3.6450236e-10 ] [ 4.3488841e-10 5.1245272e-10 1.3987624e-10 ] [ 2.3766219e-10 3.8769226e-10 1.8791188e-10 ] [ 5.6039859e-10 4.0540353e-10 3.1019137e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.58e-05 3.7e-06 1.47e-05 ] [ -5.2e-06 3.15e-05 1.1e-06 ] [ 3e-07 -3.3e-06 8.8e-06 ] [ -1.23e-05 -3.69e-05 -1.34e-05 ] [ -4.84e-05 -1.39e-05 -3.2e-06 ] [ 5.28e-05 2.08e-05 -9.6e-06 ] [ -3e-06 -1.8e-06 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.53143908172e-14 5.9280535458e-15 2.35519965198e-14 ] [ -8.331318496799998e-15 5.046856397099999e-14 1.7623942974e-15 ] [ 4.806529901999999e-16 -5.2871828922e-15 1.40991543792e-14 ] [ -1.97067725982e-14 -5.91203177946e-14 -2.14691668956e-14 ] [ -7.754534908559998e-14 -2.22702552126e-14 -5.1269652288e-15 ] [ 8.45949262752e-14 3.332527398719999e-14 -1.53808956864e-14 ] [ -4.806529901999999e-15 -2.8839179412e-15 2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.332059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.77690199489094e-18 } }