{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.5844074 34.0494847 -77.398651 ] [ 19.2275865 -36.8862861 76.7676311 ] [ 1.6364022 2.3396467 0.6482912 ] [ -0.2795812 0.4971547 -0.0172713 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.297985656101669e-08 5.455328878608049e-08 -1.240063101353207e-07 ] [ 3.080598981851384e-08 -5.909834570445898e-08 1.229953047959517e-07 ] [ 2.621805368666194e-09 3.748527274555207e-09 1.038677012667821e-09 ] [ -4.479384659456807e-10 7.965296438232798e-10 -2.76716732988042e-11 ] ] } "unrelaxed-potential-energy" { "source-value" 17.468272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.798725723475645e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.148344 0.9775232 0.2330252 ] [ 0.2339698 -0.5269311 2.0795484 ] [ 0.7721725 2.7487527 0.5458971 ] [ 3.0349636 2.4168202 1.3132246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48344e-11 9.775232000000001e-11 2.330252e-11 ] [ 2.339698e-11 -5.269311e-11 2.0795484e-10 ] [ 7.721725000000001e-11 2.7487527e-10 5.458971e-11 ] [ 3.034963600000001e-10 2.4168202e-10 1.3132246e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 1.2e-05 3.2e-06 ] [ -2e-07 7e-07 -8e-07 ] [ -6.6e-06 -1.23e-05 -2.2e-06 ] [ -5e-07 -3e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.15356717648e-14 1.9226119608e-14 5.1269652288e-15 ] [ -3.204353268e-16 1.1215236438e-15 -1.2817413072e-15 ] [ -1.05743657844e-14 -1.97067725982e-14 -3.5247885948e-15 ] [ -8.010883169999999e-16 -4.806529901999999e-16 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.5469575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.369373559829105e-18 } }