{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3353828 0.0613515 0.2223859 ] [ 3.9916685 0.5125478 0.3870079 ] [ -0.0124151 -0.127962 -1.4932077 ] [ 2.121523 -2.5618389 -2.8412835 ] [ -1.3133493 -0.8877858 2.0856367 ] [ -1.0113684 1.4215478 -0.4395724 ] [ 0.5593241 1.5821396 2.0790331 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.946048964378443e-09 9.829593895101121e-11 3.563014897755667e-10 ] [ 6.395357948683805e-09 8.211921022024742e-10 6.200550094449043e-10 ] [ -1.989118296489408e-11 -2.050177247508096e-10 -2.39238246693854e-09 ] [ 3.399054551089478e-09 -4.104518391835989e-09 -4.552237996764796e-09 ] [ -2.104217543404046e-09 -1.422389653038225e-09 3.341558360222463e-09 ] [ -1.620390805495903e-09 2.277570650509674e-09 -7.042726224289458e-10 ] [ 8.961359964700013e-10 2.534867077961864e-09 3.330978226689349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.892109 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347284859900527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1388288 2.9749806 0.898823 ] [ 1.4697586 2.711541 2.5410478 ] [ 2.3134134 4.556671 3.8175456 ] [ 4.6527905 2.0261875 2.434989 ] [ 3.095001 2.2539942 4.2425007 ] [ 3.6213466 5.064946 1.8741782 ] [ 4.7253822 4.0373327 3.7371896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1388288e-10 2.9749806e-10 8.988230000000001e-11 ] [ 1.4697586e-10 2.711541e-10 2.5410478e-10 ] [ 2.3134134e-10 4.556671e-10 3.8175456e-10 ] [ 4.6527905e-10 2.0261875e-10 2.434989e-10 ] [ 3.095001e-10 2.2539942e-10 4.2425007e-10 ] [ 3.6213466e-10 5.064946e-10 1.8741782e-10 ] [ 4.7253822e-10 4.037332700000001e-10 3.7371896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 -1.6e-06 -1.61e-05 ] [ 1.47e-05 3.9e-06 9.9e-06 ] [ -9.2e-06 -1.7e-06 -7.3e-06 ] [ 1.6e-06 -1.04e-05 9.5e-06 ] [ -5.4e-06 -2.8e-06 1.9e-06 ] [ -9.3e-06 1.92e-05 -1.5e-06 ] [ 1.28e-05 -6.5e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.17110076608e-15 -2.56348259328e-15 -2.579504359488e-14 ] [ 2.355199632576e-14 6.24848882112e-15 1.586154854592e-14 ] [ -1.474002491136e-14 -2.72370025536e-15 -1.169588933184e-14 ] [ 2.56348259328e-15 -1.666263685632e-14 1.52206778976e-14 ] [ -8.65175375232e-15 -4.48609453824e-15 3.04413557952e-15 ] [ -1.490024257344e-14 3.076179111936e-14 -2.4032649312e-15 ] [ 2.050786074624e-14 -1.04141480352e-14 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }