{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.266958 0.2808875 2.923165 ] [ 1.972839 2.886908 2.420784 ] [ 0.6227844 1.897999 3.691493 ] [ 3.0949 1.65874 4.813271 ] [ 4.223624 2.255199 3.062463 ] [ 4.675559 3.55825 4.934237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.266958e-10 2.808875e-11 2.923165e-10 ] [ 1.972839e-10 2.886908e-10 2.420784e-10 ] [ 6.227844000000001e-11 1.897999e-10 3.691493e-10 ] [ 3.0949e-10 1.65874e-10 4.813271e-10 ] [ 4.223624e-10 2.255199e-10 3.062463e-10 ] [ 4.675559e-10 3.55825e-10 4.934237000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1732232 -0.0960258 -0.8724068 ] [ 2.1436457 2.0474039 -3.0807694 ] [ -2.9720582 -1.9588745 3.0924377 ] [ -2.6038899 -1.0766885 4.2784285 ] [ 2.7264428 0.0387962 -4.5069327 ] [ 0.5326365 1.0453887 1.0892426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.775341612201625e-10 -1.538502917536166e-10 -1.397749778786942e-09 ] [ 3.434499023818451e-09 3.280302661914741e-09 -4.935936706756044e-09 ] [ -4.761762163696931e-09 -3.13846292698129e-09 4.954631384220524e-09 ] [ -4.17189152091725e-09 -1.725045142584221e-09 6.854798116464414e-09 ] [ 4.368242912108491e-09 6.215836461588096e-11 -7.220902203459021e-09 ] [ 8.533777476847392e-10 1.674897334788505e-09 1.745159028099406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.742474 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.682440041715186e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3659654 0.5320687 2.6786386 ] [ 2.350161 3.1655185 2.7381544 ] [ 0.6111309 1.7732555 3.9202276 ] [ 2.8671746 1.6000775 5.0338585 ] [ 4.5533911 1.7485727 3.0155789 ] [ 4.1088415 3.7184907 4.458955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3659654e-10 5.320687e-11 2.6786386e-10 ] [ 2.350161e-10 3.1655185e-10 2.7381544e-10 ] [ 6.111309000000001e-11 1.7732555e-10 3.9202276e-10 ] [ 2.8671746e-10 1.6000775e-10 5.0338585e-10 ] [ 4.5533911e-10 1.7485727e-10 3.0155789e-10 ] [ 4.1088415e-10 3.7184907e-10 4.458955e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.37e-05 1.82e-05 3.34e-05 ] [ 1.23e-05 -2.98e-05 -0.0 ] [ 1.47e-05 1.27e-05 -1.2e-05 ] [ -1.8e-06 -0.0 -1.22e-05 ] [ -3.15e-05 2.33e-05 -1.81e-05 ] [ -7.4e-06 -2.44e-05 8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.194981970496e-14 2.915961449856e-14 5.351269913472e-14 ] [ 1.970677243584e-14 -4.774486329984001e-14 0.0 ] [ 2.355199632576e-14 2.034764308416e-14 -1.92261194496e-14 ] [ -2.88391791744e-15 0.0 -1.954655477376e-14 ] [ -5.04685635552e-14 3.733071526464e-14 -2.899939683648e-14 ] [ -1.185610699392e-14 -3.909310954752e-14 1.425937192512e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }