{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.9396703 -3.9841843 5.3794888 ] [ 3.8213126 -3.6663523 -0.6276136 ] [ -3.8213126 3.6663523 0.6276136 ] [ -12.95833 4.5032715 -5.5008393 ] [ 0.0186598 -0.5190873 0.1213506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.073163723552012e-08 -6.383366938418414e-09 8.618891187215448e-09 ] [ 6.122417708488463e-09 -5.874143938676307e-09 -1.005547836816123e-09 ] [ -6.122417708488463e-09 5.874143938676307e-09 1.005547836816123e-09 ] [ -2.076153337061126e-08 7.215036314414948e-09 -8.813316121237838e-09 ] [ 2.989629530880384e-11 -8.31669536214196e-10 1.944250942400525e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0010844 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.206090641927595e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7620618 2.8287076 3.0319878 ] [ 2.4944724 3.245701 0.8879989 ] [ 3.2145679 4.0059717 -1.0476057 ] [ 4.1184846 2.9405203 4.7625135 ] [ 6.0433963 3.4649944 5.6894266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7620618e-10 2.8287076e-10 3.0319878e-10 ] [ 2.4944724e-10 3.245701e-10 8.879989000000001e-11 ] [ 3.2145679e-10 4.0059717e-10 -1.0476057e-10 ] [ 4.1184846e-10 2.9405203e-10 4.7625135e-10 ] [ 6.0433963e-10 3.4649944e-10 5.689426600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.098475 0.0047586 0.1396386 ] [ 0.0049203 0.0380275 -0.1453308 ] [ -0.0615421 -0.0243395 -0.0009091 ] [ -0.0999307 -0.0192735 -0.0840475 ] [ 0.0580776 0.0008269 0.0906489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.5777434273328e-10 7.62411766773888e-12 2.237257002812429e-10 ] [ 7.88318962732224e-12 6.0926771447472e-11 -2.328456100421607e-10 ] [ -9.860131381493568e-11 -3.89961778619616e-11 -1.45653876596928e-12 ] [ -1.601066312401786e-10 -3.08795511009888e-11 -1.34658939536688e-10 ] [ 9.305057291217408e-11 1.32483984773952e-12 1.452355482812371e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.115771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.780942841836664e-18 } }