{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7262768 -2.5767117 -4.7414972 ] [ -4.6202604 -3.3726056 3.6197076 ] [ -3.6458751 7.6967778 -3.8573565 ] [ 5.2267467 -0.2490032 -1.7357499 ] [ 3.44419 -4.0563964 1.6805345 ] [ 0.833872 -0.1201378 -0.7414034 ] [ 4.4876035 2.678077 5.7757648 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.17450688877629e-09 -4.128347278294417e-09 -7.596716024016425e-09 ] [ -7.402473255875493e-09 -5.40350988801755e-09 5.799410938632217e-09 ] [ -5.841335895702413e-09 1.233159754824992e-08 -6.18016645330802e-09 ] [ 8.374171434576606e-09 -3.989471088312288e-10 -2.780977932247837e-09 ] [ 5.518200741056459e-09 -6.499063530321716e-09 2.692513108530873e-09 ] [ 1.336010234146848e-09 -1.924819760201652e-10 -1.187859203848156e-09 ] [ 7.189933470356618e-09 4.290752393452817e-09 9.253795406039681e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.982955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.919881050727347e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6531531 2.4303733 1.719235 ] [ 1.7252458 2.5773941 4.6401593 ] [ 2.3116184 4.4236565 3.0753273 ] [ 4.9404426 2.0812385 1.3805679 ] [ 3.943742 1.9326714 3.801703 ] [ 4.4242566 4.5435208 1.9052854 ] [ 3.8349104 4.0991093 4.9608702 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6531531e-10 2.4303733e-10 1.719235e-10 ] [ 1.7252458e-10 2.5773941e-10 4.6401593e-10 ] [ 2.3116184e-10 4.4236565e-10 3.0753273e-10 ] [ 4.9404426e-10 2.0812385e-10 1.3805679e-10 ] [ 3.943742e-10 1.9326714e-10 3.801703e-10 ] [ 4.4242566e-10 4.5435208e-10 1.9052854e-10 ] [ 3.8349104e-10 4.0991093e-10 4.9608702e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1746171 -0.2750745 0.001942 ] [ -0.241026 -0.0098724 0.0034035 ] [ -0.2111972 0.3127115 0.0341349 ] [ 0.4055781 -0.1233119 -0.5505028 ] [ -0.3642659 -0.2959643 0.4972854 ] [ -0.151117 0.3553508 -0.0724016 ] [ 0.3874109 0.0361608 0.0861386 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.797674375168414e-10 -4.407179365092329e-10 3.111427023227999e-12 ] [ -3.861662253864839e-10 -1.58173286015016e-11 5.453008173818999e-12 ] [ -3.383752190062248e-10 5.010190584830909e-10 5.46901391839266e-11 ] [ 6.498077550821153e-10 -1.975674448741446e-10 -8.82002723111575e-10 ] [ -5.836183135429805e-10 -4.741870859581661e-10 7.967390483093434e-10 ] [ -2.42116126400178e-10 5.693347486332072e-10 -1.160001517842144e-10 ] [ 6.207006917369106e-10 5.793598882674719e-11 1.380092522054724e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.902932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227495279449088e-18 } }