{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 26.6491376 1.5361349 27.686743 ] [ 7.2631014 11.7039579 -4.398148 ] [ -17.0002187 2.5530361 -35.8174061 ] [ 25.7033341 -20.5157877 15.4270297 ] [ -18.7589784 0.583085 6.4081169 ] [ -4.6357082 14.545161 -6.3048581 ] [ -19.2206678 -10.4055871 -3.0014773 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.269662557897083e-08 2.461159443451926e-09 4.435905270616305e-08 ] [ 1.163677135345269e-08 1.875180787269971e-08 -7.046609958473831e-09 ] [ -2.723735317402986e-08 4.090414785178487e-09 -5.738581114390906e-08 ] [ 4.118128131091541e-08 -3.28699156810446e-08 2.471682651736402e-08 ] [ -3.005519687019071e-08 9.342051626358898e-10 1.026693516512051e-08 ] [ -7.427223360082198e-09 2.330391709196807e-08 -1.010149632850563e-08 ] [ -3.079490483903618e-08 -1.667158851467182e-08 -4.808896797541408e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.6647827236328325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.06781591504914e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 26.6491376 1.5361349 27.686743 ] [ 7.2631014 11.7039579 -4.398148 ] [ -17.0002187 2.5530361 -35.8174061 ] [ 25.7033341 -20.5157877 15.4270297 ] [ -18.7589784 0.583085 6.4081169 ] [ -4.6357082 14.545161 -6.3048581 ] [ -19.2206678 -10.4055871 -3.0014773 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.269662557897083e-08 2.461159443451926e-09 4.435905270616305e-08 ] [ 1.163677135345269e-08 1.875180787269971e-08 -7.046609958473831e-09 ] [ -2.723735317402986e-08 4.090414785178487e-09 -5.738581114390906e-08 ] [ 4.118128131091541e-08 -3.28699156810446e-08 2.471682651736402e-08 ] [ -3.005519687019071e-08 9.342051626358898e-10 1.026693516512051e-08 ] [ -7.427223360082198e-09 2.330391709196807e-08 -1.010149632850563e-08 ] [ -3.079490483903618e-08 -1.667158851467182e-08 -4.808896797541408e-09 ] ] } "relaxed-potential-energy" { "source-value" 6.6647827236328325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.06781591504914e-18 } }