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fix typos

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This commit is contained in:
Axel Kohlmeyer
2021-08-17 10:05:58 -04:00
parent 0dbcb5dd66
commit 42fadf55cf
1 changed files with 2 additions and 2 deletions
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4
src/ASPHERE/pair_resquared.cpp
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@ -728,7 +728,7 @@ double PairRESquared::resquared_analytic(const int i, const int j,
u[0] = -rhat[m]*rhat[0];
u[1] = -rhat[m]*rhat[1];
u[2] = -rhat[m]*rhat[2];
u[i] += 1.0;
u[m] += 1.0;
u[0] /= rnorm;
u[1] /= rnorm;
u[2] /= rnorm;
@ -750,7 +750,7 @@ double PairRESquared::resquared_analytic(const int i, const int j,
deta -= ddH*tdH;
deta -= dsigma1*teta1+dsigma2*teta2;
dchi = MathExtra::dot3(u,fourw);
dh12 = rhat[i]+MathExtra::dot3(u,spr);
dh12 = rhat[m]+MathExtra::dot3(u,spr);
dUa = pbsu*(eta*dchi+deta*chi)-dh12*dspu;
dUr = pbsr*(eta*dchi+deta*chi)-dh12*dspr;
fforce[m]=dUr*Ur+dUa*Ua;