{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9398812 2.717033 1.670565 ] [ 2.278193 2.647912 4.038221 ] [ 1.856764 5.001969 2.684043 ] [ 3.35912 1.891848 2.112837 ] [ 5.060666 2.631323 3.812603 ] [ 4.070835 4.158298 1.920429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.398812e-11 2.717033e-10 1.670565e-10 ] [ 2.278193e-10 2.647912e-10 4.038221e-10 ] [ 1.856764e-10 5.001969e-10 2.684043e-10 ] [ 3.35912e-10 1.891848e-10 2.112837e-10 ] [ 5.060666e-10 2.631323e-10 3.812603e-10 ] [ 4.070835e-10 4.158298e-10 1.920429e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3227302 0.0390562 -4.3868783 ] [ -6.7302501 -2.9270266 12.9405805 ] [ -0.2328248 2.6092904 -0.4794879 ] [ 0.403471 -7.624578 -7.0325513 ] [ 8.016685 -0.2925869 5.5983465 ] [ 3.8656492 8.1958448 -6.6400095 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.527953885266107e-09 6.257493053728896e-11 -7.028553850554849e-09 ] [ -1.078304936235686e-08 -4.689613586979713e-09 2.073309553668037e-08 ] [ -3.730264513024358e-10 4.18054407575788e-09 -7.682243033364883e-10 ] [ 6.464318033707968e-10 -1.221592061506602e-08 -1.126738927743665e-08 ] [ 1.284414528331805e-08 -4.687758907323476e-10 8.969539877437506e-09 ] [ 6.193452772454224e-09 1.313119092626525e-08 -1.06384679827899e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8574579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.782505483900265e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9808561 2.5917254 1.5060649 ] [ 2.5618652 3.4641467 5.020111 ] [ 1.886942 4.3655751 2.8789953 ] [ 3.164221 2.0074715 0.6687913 ] [ 4.7452356 2.8798971 4.1828448 ] [ 4.2263392 3.7395673 1.9818907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.808561e-11 2.5917254e-10 1.5060649e-10 ] [ 2.5618652e-10 3.4641467e-10 5.020111e-10 ] [ 1.886942e-10 4.3655751e-10 2.8789953e-10 ] [ 3.164221e-10 2.0074715e-10 6.687913e-11 ] [ 4.7452356e-10 2.8798971e-10 4.1828448e-10 ] [ 4.2263392e-10 3.7395673e-10 1.9818907e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.12e-05 1.4e-06 -1.13e-05 ] [ 1.03e-05 6.2e-06 1.31e-05 ] [ -2.36e-05 6.9e-06 9.7e-06 ] [ 1.09e-05 -7.3e-06 -9e-06 ] [ -9e-07 5e-07 -4.7e-06 ] [ 1.44e-05 -7.6e-06 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.794437815296e-14 2.24304726912e-15 -1.810459581504e-14 ] [ 1.650241919424e-14 9.93349504896e-15 2.098851373248e-14 ] [ -3.781136825088e-14 1.105501868352e-14 1.554111322176e-14 ] [ 1.746372516672e-14 -1.169588933184e-14 -1.44195895872e-14 ] [ -1.44195895872e-15 8.010883104e-16 -7.53023011776e-15 ] [ 2.307134333952e-14 -1.217654231808e-14 3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.100632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.098952630810435e-18 } }