{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3093171 2.4188568 0.7919505 ] [ -2.2190308 -3.470548 -5.7269953 ] [ -7.7243583 0.0735171 4.8568825 ] [ 4.3909899 -2.1641364 -0.0514308 ] [ -3.2486304 -2.0313165 3.2926899 ] [ 10.8296243 0.322926 2.5491545 ] [ -2.3379119 4.8507009 -5.7122512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.955806260336557e-10 3.875435814023101e-09 1.26884457593087e-09 ] [ -3.555279268595121e-09 -5.560430866964198e-09 -9.175657977091482e-09 ] [ -1.237578627894243e-08 1.177873788490157e-10 7.781583591472656e-09 ] [ 7.03514135994893e-09 -3.467328744302277e-09 -8.240122534904064e-11 ] [ -5.204879676500153e-09 -3.254527805745283e-09 5.275470777324291e-09 ] [ 1.735097086550757e-08 5.173844874484608e-10 4.084195742707114e-09 ] [ -3.745747787670108e-09 7.771679576473518e-09 -9.152035324776746e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1195259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.461109118976008e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6300724 1.9695511 1.8763393 ] [ 2.5083995 0.3876016 3.9335677 ] [ 1.3499383 1.7978787 5.1610532 ] [ 1.9413754 3.4783058 2.8030498 ] [ 4.603865 0.3198006 3.257811 ] [ 5.6007091 2.2800985 3.4089582 ] [ 4.0201253 3.8227225 3.4350129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.300724e-11 1.9695511e-10 1.8763393e-10 ] [ 2.5083995e-10 3.876016e-11 3.9335677e-10 ] [ 1.3499383e-10 1.7978787e-10 5.161053199999999e-10 ] [ 1.9413754e-10 3.4783058e-10 2.8030498e-10 ] [ 4.603865e-10 3.198006e-11 3.257811e-10 ] [ 5.6007091e-10 2.2800985e-10 3.4089582e-10 ] [ 4.0201253e-10 3.8227225e-10 3.4350129e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1421327 0.3709643 0.1852595 ] [ 0.0007536 -0.2540646 0.025091 ] [ -0.2811428 -0.015522 0.0753512 ] [ -0.5891059 -0.2334199 -0.278511 ] [ 0.1054919 -0.2429455 0.0437449 ] [ -0.1237791 0.516429 -0.0549923 ] [ 0.7456497 -0.1414412 0.0040567 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.277216889911802e-10 5.943503286114375e-10 2.968184396810976e-10 ] [ 1.20740030143488e-12 -4.070563622929037e-10 4.02002135924928e-11 ] [ -4.504404212662503e-10 -2.48689855080576e-11 1.20725930989225e-10 ] [ -9.438517001553426e-10 -3.73979906609474e-10 -4.462238128356288e-10 ] [ 1.690166558637715e-10 -3.892416002285664e-10 7.008705605923393e-11 ] [ -1.983159801636653e-10 8.274104701031232e-10 -8.810737738401984e-11 ] [ 1.194662516646534e-09 -2.266137838578969e-10 6.49954989759936e-12 ] ] } "relaxed-potential-energy" { "source-value" -15.421213 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.470750693297703e-18 } }