{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8594843 0.7172344 0.0157799 ] [ 0.2882733 0.8856534 2.226981 ] [ 1.449769 2.87204 1.321697 ] [ 2.751005 0.6869835 1.2059 ] [ 2.852604 2.214321 2.896583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.594843e-11 7.172344000000001e-11 1.57799e-12 ] [ 2.882733e-11 8.856534000000001e-11 2.226981e-10 ] [ 1.449769e-10 2.87204e-10 1.321697e-10 ] [ 2.751005e-10 6.869835e-11 1.2059e-10 ] [ 2.852604e-10 2.214321e-10 2.896583e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9212441 0.370339 -0.8537066 ] [ 0.2130896 0.280131 0.1233778 ] [ -1.2286769 -0.2512987 -1.1417219 ] [ 0.886778 -0.3688161 0.3917565 ] [ 1.0500535 -0.0303551 1.4802941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.475995759069937e-09 5.933484875704511e-10 -1.367788755542657e-09 ] [ 3.414071752556237e-10 4.488193389613248e-10 1.976730266857382e-10 ] [ -1.96855740369702e-09 -4.02624901977433e-10 -1.829240135635356e-09 ] [ 1.420774979439782e-09 -5.909085327946348e-10 6.276631053464352e-10 ] [ 1.682371168289213e-09 -4.863423154204608e-11 2.371692598928178e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.364141399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.992125319719635e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0725852 1.0593307 -0.0121684 ] [ 0.680641 0.9542327 2.3186125 ] [ 1.0385612 3.0396407 1.2602327 ] [ 2.7216857 0.1713588 1.4139319 ] [ 2.6876625 2.1516693 2.6863323 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0725852e-10 1.0593307e-10 -1.21684e-12 ] [ 6.806410000000001e-11 9.542327e-11 2.3186125e-10 ] [ 1.0385612e-10 3.0396407e-10 1.2602327e-10 ] [ 2.7216857e-10 1.713588e-11 1.4139319e-10 ] [ 2.6876625e-10 2.1516693e-10 2.6863323e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 2.8e-06 5.7e-06 ] [ -2.6e-06 -2.2e-06 4.5e-06 ] [ 4e-07 5.3e-06 -4.4e-06 ] [ 5.4e-06 -8e-07 -1.1e-06 ] [ -4.9e-06 -5.1e-06 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 4.48609453824e-15 9.13240673856e-15 ] [ -4.16565921408e-15 -3.52478856576e-15 7.2097947936e-15 ] [ 6.408706483200001e-16 8.491536090240001e-15 -7.04957713152e-15 ] [ 8.65175375232e-15 -1.28174129664e-15 -1.76239428288e-15 ] [ -7.850665441919999e-15 -8.17110076608e-15 -7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }