{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7558208 -0.6917304 -2.2324812 ] [ -2.2406118 -10.4139577 8.3517554 ] [ -10.0526714 1.5717828 -4.2909906 ] [ 0.7973989 -2.7485082 -10.7775562 ] [ 1.6151901 2.1024907 9.1205921 ] [ 5.2628538 3.6775309 -8.4705549 ] [ 5.3736612 6.5023919 8.2992354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.210958415274353e-09 -1.108274274776632e-09 -3.576829185015529e-09 ] [ -3.589855842248606e-09 -1.668499955694014e-08 1.338098724452015e-08 ] [ -1.610615509366481e-08 2.518273655135563e-09 -6.874924819392564e-09 ] [ 1.277573875031637e-09 -4.40359558011709e-09 -1.726754857299809e-08 ] [ 2.587819816367614e-09 3.368561444989427e-09 1.461279943047318e-08 ] [ 8.43202131704844e-09 5.892054030249583e-09 -1.357132502598288e-08 ] [ 8.609554342740072e-09 1.041798028145929e-08 1.329684092839574e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.957202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.5566255977783e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7772606 2.0433415 1.610937 ] [ 2.8407481 2.583592 3.9828818 ] [ 1.9905612 4.2336894 2.3219187 ] [ 4.9809198 2.8608623 1.2951325 ] [ 5.2343319 2.8734104 3.6530577 ] [ 4.1076343 5.0601772 1.4518982 ] [ 3.8446291 4.8600472 3.862874 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7772606e-10 2.0433415e-10 1.610937e-10 ] [ 2.8407481e-10 2.583592e-10 3.9828818e-10 ] [ 1.9905612e-10 4.2336894e-10 2.3219187e-10 ] [ 4.9809198e-10 2.8608623e-10 1.2951325e-10 ] [ 5.2343319e-10 2.8734104e-10 3.6530577e-10 ] [ 4.1076343e-10 5.060177200000001e-10 1.4518982e-10 ] [ 3.8446291e-10 4.8600472e-10 3.862874e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -1.67e-05 -7.8e-06 ] [ -4e-06 -1.05e-05 -4.4e-06 ] [ -1.09e-05 4.9e-06 5.7e-06 ] [ -1.18e-05 7.5e-06 1.1e-05 ] [ 9.5e-06 -2.7e-06 4.5e-06 ] [ 1.08e-05 5.3e-06 -9e-07 ] [ 7.4e-06 1.23e-05 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 -2.675634956736e-14 -1.249697764224e-14 ] [ -6.4087064832e-15 -1.68228545184e-14 -7.04957713152e-15 ] [ -1.746372516672e-14 7.850665441919999e-15 9.13240673856e-15 ] [ -1.890568412544e-14 1.2016324656e-14 1.76239428288e-14 ] [ 1.52206778976e-14 -4.32587687616e-15 7.2097947936e-15 ] [ 1.730350750464e-14 8.491536090240001e-15 -1.44195895872e-15 ] [ 1.185610699392e-14 1.970677243584e-14 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.567926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615780341714446e-18 } }