{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0749092e-10 2.0626923e-10 1.3604793e-10 ] [ 2.3474971e-10 1.8374556e-10 3.5374036e-10 ] [ 2.3236089e-10 3.8566827e-10 2.6498438e-10 ] [ 3.3788e-10 4.519941e-11 2.1654619e-10 ] [ 4.0484019e-10 2.5526529e-10 2.2151722e-10 ] [ 4.4324048e-10 1.2500002e-10 3.9531044e-10 ] [ 3.7804631e-10 3.3543384e-10 4.2524069e-10 ] ] "source-value" [ [ 2.0749092 2.0626923 1.3604793 ] [ 2.3474971 1.8374556 3.5374036 ] [ 2.3236089 3.8566827 2.6498438 ] [ 3.3788 0.4519941 2.1654619 ] [ 4.0484019 2.5526529 2.2151722 ] [ 4.4324048 1.2500002 3.9531044 ] [ 3.7804631 3.3543384 4.2524069 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.38107332287424e-12 6.16934129605248e-12 -1.290296919795072e-11 ] [ 1.42882111042944e-11 1.6530457285104e-11 7.08498523483968e-12 ] [ -3.84137866603008e-12 -9.918114153400321e-12 1.108513960399104e-11 ] [ -1.04517991857888e-11 -1.949624642786688e-11 4.92925659155328e-12 ] [ 6.447639375085439e-12 1.538778491914944e-11 -4.88872152304704e-12 ] [ 1.65472801396224e-12 2.33084654793984e-12 2.9584191303072e-12 ] [ -1.147847396439744e-11 -1.100406946697856e-11 -8.26594962203136e-12 ] ] "source-value" [ [ 0.0021103 0.0038506 -0.0080534 ] [ 0.008918 0.0103175 0.0044221 ] [ -0.0023976 -0.0061904 0.0069188 ] [ -0.0065235 -0.0121686 0.0030766 ] [ 0.0040243 0.0096043 -0.0030513 ] [ 0.0010328 0.0014548 0.0018465 ] [ -0.0071643 -0.0068682 -0.0051592 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.383888566788704e-18 "source-value" -52.328117 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.762733142103191e-09 2.599116122850227e-09 3.811399057536994e-09 ] [ 1.434122712867667e-08 5.238963260407417e-09 -2.739485700516432e-09 ] [ 1.348576575029658e-09 -1.367089773948301e-08 -3.025294943765365e-09 ] [ -3.433937621130523e-09 1.203413861697603e-08 4.294076393937376e-09 ] [ -1.31941784172824e-08 -4.964966064295333e-09 1.08193892915992e-08 ] [ -9.74712954399322e-09 1.023319083763439e-08 -6.292772662483588e-09 ] [ 9.227088968142797e-10 -1.146954503408972e-08 -6.867311276090523e-09 ] ] "source-value" [ [ 6.0934188 1.6222407 2.3788882 ] [ 8.95109 3.2699037 -1.7098525 ] [ 0.8417153 -8.5327033 -1.8882406 ] [ -2.1432953 7.5111186 2.6801517 ] [ -8.2351585 -3.0988881 6.7529317 ] [ -6.0836798 6.3870554 -3.9276398 ] [ 0.5759096 -7.158727 -4.2862386 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.096678260422324e-18 "source-value" -38.052473 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] } "instance-id" 1 }