{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4939538 5.5932288 3.1533144 ] [ 2.4681687 -3.0205915 -3.8719501 ] [ -0.2057176 -5.4635256 -4.0195354 ] [ 2.0341395 -0.7739178 2.1148409 ] [ -0.3984311 -2.5397433 2.9208049 ] [ -0.3236134 0.90877 -2.6390943 ] [ 1.9194078 5.2957794 2.3416196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.802284406635509e-09 8.96134049197586e-09 5.052166651335729e-09 ] [ 3.954442219910156e-09 -4.839521122159011e-09 -6.203547978233963e-09 ] [ -3.295959319225584e-10 -8.753533055580828e-09 -6.440005697415843e-09 ] [ 3.259050777196443e-09 -1.239953015796685e-09 3.38834867460753e-09 ] [ -6.383569986789173e-10 -4.069117371618052e-09 4.679645363252706e-09 ] [ -5.184858279292956e-10 1.45601005968018e-09 -4.228295222382586e-09 ] [ 3.075230328277345e-09 8.484774013498539e-09 3.751688208836426e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.481257 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.159935496234894e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6083551 3.6975889 3.1726089 ] [ 5.4432496 2.4166378 1.9276357 ] [ 3.1673961 1.6637048 1.9214733 ] [ 5.8352788 2.211727 4.3610838 ] [ 3.5143705 1.8119195 4.4073683 ] [ 3.1352211 3.9546934 0.8253214 ] [ 4.8562348 4.2557666 3.305918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6083551e-10 3.6975889e-10 3.1726089e-10 ] [ 5.4432496e-10 2.4166378e-10 1.9276357e-10 ] [ 3.1673961e-10 1.6637048e-10 1.9214733e-10 ] [ 5.8352788e-10 2.211727e-10 4.3610838e-10 ] [ 3.5143705e-10 1.8119195e-10 4.4073683e-10 ] [ 3.1352211e-10 3.9546934e-10 8.253214e-11 ] [ 4.8562348e-10 4.255766600000001e-10 3.305918e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3877019 -0.3278752 -0.2586025 ] [ 0.4365172 -1.1641364 -1.0970359 ] [ 0.0925911 -0.185925 -0.4411857 ] [ 0.6606604 -0.2594229 0.4791344 ] [ -0.5079602 -0.0429673 0.5701965 ] [ -0.3624337 0.2553578 -0.0612647 ] [ 1.0683272 1.7249689 0.8087581 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.223343559137404e-09 -5.253139843080767e-10 -4.143268829939849e-10 ] [ 6.993776581791047e-10 -1.865152138868878e-09 -1.757645285639161e-09 ] [ 1.483472969363574e-10 -2.9788469067645e-10 -7.068574197949338e-10 ] [ 1.058494655889094e-09 -4.156413087045185e-10 7.676579402256096e-10 ] [ -8.138419634419668e-10 -6.884120408606818e-11 9.135555090885808e-10 ] [ -5.806828055141657e-10 4.091283004696452e-10 -9.81568708290198e-11 ] [ 1.711648877306644e-09 2.763704865956682e-09 1.295773330378235e-09 ] ] } "relaxed-potential-energy" { "source-value" -15.165654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.429805647812863e-18 } }