{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5843887 -2.6645976 -2.2858343 ] [ -9.5602927 -2.4571303 10.6367777 ] [ -0.970985 1.6798054 -1.6046293 ] [ 0.1640488 -4.9933155 -2.1816381 ] [ 3.352444 -4.0584754 2.0261875 ] [ 9.2857835 10.0171007 -10.3663872 ] [ 1.3133902 2.4766126 3.7755238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.742823774999705e-09 -4.269155978559791e-09 -3.662310274482733e-09 ] [ -1.531727745194491e-08 -3.93675672091929e-09 1.70419965515868e-08 ] [ -1.555689466147488e-09 2.691344939373592e-09 -2.570899549510669e-09 ] [ 2.628351520302951e-10 -8.000173354378262e-09 -3.495369558866532e-09 ] [ 5.371207399341236e-09 -6.502394401971928e-09 3.2463102418572e-09 ] [ 1.48774652295104e-08 1.604916454973931e-08 -1.660878321400037e-08 ] [ 2.104283072427836e-09 3.967970806498702e-09 6.049055963633975e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.297736 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.810096848717051e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4546575 1.5058767 0.8749334 ] [ 2.8374605 4.1414056 4.2866078 ] [ 1.2858302 3.7780397 0.2810919 ] [ 3.0045849 2.0687416 2.5619807 ] [ 4.4427886 0.9702809 4.0667678 ] [ 2.7788213 4.6374703 1.8921462 ] [ 4.2958449 2.7996742 5.5402693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4546575e-10 1.5058767e-10 8.749334e-11 ] [ 2.8374605e-10 4.1414056e-10 4.2866078e-10 ] [ 1.2858302e-10 3.7780397e-10 2.810919e-11 ] [ 3.0045849e-10 2.0687416e-10 2.5619807e-10 ] [ 4.4427886e-10 9.702809000000001e-11 4.0667678e-10 ] [ 2.7788213e-10 4.6374703e-10 1.8921462e-10 ] [ 4.2958449e-10 2.7996742e-10 5.540269300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.017709 -0.0113896 -0.0091686 ] [ -0.0379401 0.1218376 0.0479477 ] [ -0.0229327 0.0054182 -0.00666 ] [ -0.0030767 -0.1174356 -0.0827041 ] [ -0.012795 0.0191232 0.0315311 ] [ 0.0064571 0.0339785 -0.0015932 ] [ 0.0525784 -0.0515322 0.0206473 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.83729457777472e-11 -1.824815084026368e-11 -1.468971656546688e-11 ] [ -6.078674121081408e-11 1.952053542543821e-10 7.682068396113216e-11 ] [ -3.674223579182016e-11 8.68091336681856e-12 -1.0670496294528e-11 ] [ -4.92941680921536e-12 -1.881525727696205e-10 -1.325065754643053e-10 ] [ -2.0499849863136e-11 3.063874395488256e-11 5.051839124810688e-11 ] [ 1.034541465816768e-11 5.443955830985281e-11 -2.55258779225856e-12 ] [ 8.423988323907072e-11 -8.256368605838975e-11 3.308062134264385e-11 ] ] } "relaxed-potential-energy" { "source-value" -17.522391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.807396520071633e-18 } }