From d3d5ac17bf671c093c35fff5e46ff3a6d6863a00 Mon Sep 17 00:00:00 2001 From: Efrem Braun Date: Wed, 7 Dec 2016 19:37:51 -0800 Subject: [PATCH] Fixed small typos in doc --- doc/src/compute_bond_local.txt | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/doc/src/compute_bond_local.txt b/doc/src/compute_bond_local.txt index 642b0e9cca..58d96f9ee4 100644 --- a/doc/src/compute_bond_local.txt +++ b/doc/src/compute_bond_local.txt @@ -51,12 +51,12 @@ relative to the center of mass (COM) velocity of the 2 atoms in the bond. The value {engvib} is the vibrational kinetic energy of the two atoms -in the bond, which is simply 1/2 m1 v1^2 + 1/2 m1 v2^2, where v1 and +in the bond, which is simply 1/2 m1 v1^2 + 1/2 m2 v2^2, where v1 and v2 are the magnitude of the velocity of the 2 atoms along the bond direction, after the COM velocity has been subtracted from each. The value {engrot} is the rotationsl kinetic energy of the two atoms -in the bond, which is simply 1/2 m1 v1^2 + 1/2 m1 v2^2, where v1 and +in the bond, which is simply 1/2 m1 v1^2 + 1/2 m2 v2^2, where v1 and v2 are the magnitude of the velocity of the 2 atoms perpendicular to the bond direction, after the COM velocity has been subtracted from each. @@ -67,7 +67,7 @@ Vcm^2 where Vcm = magnitude of the velocity of the COM. Note that these 3 kinetic energy terms are simply a partitioning of the summed kinetic energy of the 2 atoms themselves. I.e. total KE = -1/2 m1 v1^2 + 1/2 m2 v3^2 = engvib + engrot + engtrans, where v1,v2 +1/2 m1 v1^2 + 1/2 m2 v2^2 = engvib + engrot + engtrans, where v1,v2 are the magnitude of the velocities of the 2 atoms, without any adjustment for the COM velocity.