{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7862077 0.7348627 -0.5076772 ] [ 0.0862285 -6.2932305 3.6792985 ] [ -4.5180298 0.6939108 -2.7232381 ] [ -4.2229101 -2.2000131 -11.3607598 ] [ -0.1501696 4.1822433 10.4393761 ] [ 3.3019923 -0.1973466 -3.0006506 ] [ 3.716681 3.0795733 3.4736511 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.86182021683294e-09 1.177379837437964e-09 -8.133885407532059e-10 ] [ 1.381532867466528e-10 -1.00828667764055e-08 5.894886037644508e-09 ] [ -7.2386817176377e-09 1.111767660680625e-09 -4.363108416691813e-09 ] [ -6.76584783396019e-09 -3.524809554273732e-09 -1.820194374608449e-08 ] [ -2.405982222748877e-10 6.70069243775744e-09 1.672572432315828e-08 ] [ 5.29037486512162e-09 -3.161841087143693e-10 -4.807572238509493e-09 ] [ 5.954779405171565e-09 4.934020343299904e-09 5.565402581236203e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.698733 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.117390919678145e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6212087 2.2496105 1.4272708 ] [ 3.0701306 2.5611206 3.7181572 ] [ 2.0050468 4.2520032 2.4066002 ] [ 4.8875162 2.6471998 1.4912689 ] [ 5.3453463 3.1686487 3.6859898 ] [ 4.0851652 4.7919045 1.5863027 ] [ 3.7616712 4.8446327 3.8631103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6212087e-10 2.2496105e-10 1.4272708e-10 ] [ 3.0701306e-10 2.5611206e-10 3.7181572e-10 ] [ 2.0050468e-10 4.2520032e-10 2.4066002e-10 ] [ 4.887516200000001e-10 2.6471998e-10 1.4912689e-10 ] [ 5.345346300000001e-10 3.1686487e-10 3.685989800000001e-10 ] [ 4.0851652e-10 4.7919045e-10 1.5863027e-10 ] [ 3.7616712e-10 4.8446327e-10 3.8631103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.85e-05 1.28e-05 2.26e-05 ] [ 4.38e-05 5.17e-05 -6.09e-05 ] [ -6.4e-06 2e-07 2.29e-05 ] [ -1.17e-05 -1.84e-05 1.3e-06 ] [ -2.72e-05 -3.27e-05 3.38e-05 ] [ -3.76e-05 1e-06 -1.19e-05 ] [ 6e-07 -1.46e-05 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.16837999008e-14 2.050786074624e-14 3.620919163008e-14 ] [ 7.017533599104001e-14 8.283253129536002e-14 -9.757255620672e-14 ] [ -1.025393037312e-14 3.2043532416e-16 3.668984461632e-14 ] [ -1.874546646336e-14 -2.948004982272e-14 2.08282960704e-15 ] [ -4.357920408576e-14 -5.239117550016001e-14 5.415356978304e-14 ] [ -6.024184094208e-14 1.6021766208e-15 -1.906590178752e-14 ] [ 9.6130597248e-16 -2.339177866368e-14 -1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.346602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.862061624512252e-18 } }