{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7689337 -2.027572 -0.4006179 ] [ -0.2185202 -0.2783179 1.369902 ] [ 8.1242398 2.1587199 1.1017089 ] [ 1.3191999 -0.8151813 -0.755785 ] [ 3.094707 1.4465782 -2.8645545 ] [ 0.342426 2.8124965 1.2184058 ] [ -9.8931188 -3.2967235 0.3309407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.436320838685241e-09 -3.248528455388698e-09 -6.418606332539924e-10 ] [ -3.501079556125402e-10 -4.459144325301523e-10 2.194824957187162e-09 ] [ 1.301646706933287e-08 3.458650554635714e-09 1.765132242507285e-09 ] [ 2.113591237941698e-09 -1.306064420573351e-09 -1.210901057351328e-09 ] [ 4.958267203626106e-09 2.317673772198947e-09 -4.589522248907433e-09 ] [ 5.486269315540608e-10 4.506116138381827e-09 1.952101287407121e-09 ] [ -1.585052364815695e-08 -5.281933316941949e-09 5.302254524111865e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.773039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.007772418716662e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4672258 2.3445448 2.4510422 ] [ 2.2619392 1.3869221 4.5903948 ] [ 2.5715728 4.4794218 2.1913834 ] [ 2.0384624 3.848506 4.463487 ] [ 3.7244239 1.2933179 2.5959472 ] [ 4.2956624 2.7972781 4.6083938 ] [ 4.6757814 3.4994454 2.3264726 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4672258e-10 2.3445448e-10 2.4510422e-10 ] [ 2.2619392e-10 1.3869221e-10 4.590394800000001e-10 ] [ 2.571572800000001e-10 4.4794218e-10 2.1913834e-10 ] [ 2.0384624e-10 3.848506e-10 4.463487e-10 ] [ 3.7244239e-10 1.2933179e-10 2.5959472e-10 ] [ 4.2956624e-10 2.7972781e-10 4.6083938e-10 ] [ 4.6757814e-10 3.4994454e-10 2.3264726e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.02e-05 1.15e-05 -9.4e-06 ] [ 1.78e-05 9.6e-06 5.3e-06 ] [ -3e-06 -6.5e-06 2.4e-05 ] [ 2.14e-05 4.2e-06 -2.7e-05 ] [ 5.8e-06 -1.39e-05 -4e-07 ] [ -2.38e-05 -9.1e-06 8.5e-06 ] [ -2.84e-05 4.1e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.634220153216e-14 1.84250311392e-14 -1.506046023552e-14 ] [ 2.851874385024e-14 1.538089555968e-14 8.491536090240001e-15 ] [ -4.8065298624e-15 -1.04141480352e-14 3.84522388992e-14 ] [ 3.428657968511999e-14 6.72914180736e-15 -4.32587687616e-14 ] [ 9.292624400640001e-15 -2.227025502912e-14 -6.408706483200001e-16 ] [ -3.813180357504e-14 -1.457980724928e-14 1.36185012768e-14 ] [ -4.550181603071999e-14 6.568924145279999e-15 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210063337869e-18 } }