{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1969636 -1.1070182 -4.1413475 ] [ -0.9144187 -2.6120816 5.025178 ] [ 3.1069423 -5.3721492 -1.2999758 ] [ -0.2714972 3.0544039 5.5469063 ] [ 0.6015785 0.6366059 1.1410036 ] [ 0.6147373 8.10564 -4.5285614 ] [ 0.0596214 -2.705401 -1.7432031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.122100379668522e-09 -1.773638693452739e-09 -6.635170197774314e-09 ] [ -1.465060274832656e-09 -4.185016105621333e-09 8.051222773290851e-09 ] [ 4.977870356246218e-09 -8.607131922601792e-09 -2.082790851525457e-09 ] [ -4.349864700364247e-10 4.893694559378472e-09 8.887123664847392e-09 ] [ 9.63835016216769e-10 1.019955098046541e-09 1.828089307229882e-09 ] [ 9.84917738108248e-10 1.298666701161576e-08 -7.255555260714328e-09 ] [ 9.552401396636759e-11 -4.334530267800234e-09 -2.792919275136365e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.839886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.537829523442372e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1355006 1.5450052 1.4751019 ] [ 1.9432945 1.4165533 3.8604171 ] [ 3.8787375 0.4462644 2.6986526 ] [ 4.0689371 2.6820917 3.746384 ] [ 5.4441307 4.0823752 2.2282132 ] [ 3.1623783 3.6844819 1.3995601 ] [ 3.4783535 5.0682857 3.4087221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1355006e-10 1.5450052e-10 1.4751019e-10 ] [ 1.9432945e-10 1.4165533e-10 3.8604171e-10 ] [ 3.8787375e-10 4.462644000000001e-11 2.6986526e-10 ] [ 4.068937100000001e-10 2.6820917e-10 3.746384e-10 ] [ 5.4441307e-10 4.0823752e-10 2.2282132e-10 ] [ 3.1623783e-10 3.684481900000001e-10 1.3995601e-10 ] [ 3.4783535e-10 5.0682857e-10 3.4087221e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.92e-05 2.43e-05 6.49e-05 ] [ 2.04e-05 -3.82e-05 -1.19e-05 ] [ -1.51e-05 -3.8e-06 -1.73e-05 ] [ -1.94e-05 2.91e-05 -3.75e-05 ] [ -3.76e-05 1.79e-05 3.36e-05 ] [ 7.61e-05 3.2e-06 2.18e-05 ] [ 4.6e-06 -3.25e-05 -5.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.67835577128e-14 3.893289220619999e-14 1.039812635466e-13 ] [ 3.26844033336e-14 -6.12031474188e-14 -1.90659019446e-14 ] [ -2.41928671734e-14 -6.088271209199999e-15 -2.77176557682e-14 ] [ -3.10822266996e-14 4.66233400494e-14 -6.008162377499999e-14 ] [ -6.024184143839999e-14 2.86789617486e-14 5.383313490239999e-14 ] [ 1.219256418474e-13 5.1269652288e-15 3.492745062119999e-14 ] [ 7.370012516399999e-15 -5.207074060499999e-14 -8.587666758239999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.827198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.176667335329153e-18 } }