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Added module for integrators
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4 changed files with 66 additions and 34 deletions
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@ -29,6 +29,11 @@ include("Fields/Fields.jl")
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using .Fields
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export vector_field, scalar_field, nscalar_field
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include("MD/MD.jl")
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using .MD
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export IntrScheme
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export omf4, leapfrog
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include("YM/YM.jl")
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using .YM
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35
src/MD/MD.jl
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35
src/MD/MD.jl
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@ -0,0 +1,35 @@
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###
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### "THE BEER-WARE LICENSE":
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### Alberto Ramos wrote this file. As long as you retain this
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### notice you can do whatever you want with this stuff. If we meet some
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### day, and you think this stuff is worth it, you can buy me a beer in
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### return. <alberto.ramos@cern.ch>
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###
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### file: MD.jl
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### created: Fri Oct 8 21:53:14 2021
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###
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module MD
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# Dalla Brida / Luscher coefficients of
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# fourth order integrator
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const r1 = 0.08398315262876693
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const r2 = 0.25397851084105950
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const r3 = 0.68223653357190910
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const r4 = -0.03230286765269967
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const r5 = 0.5-r1-r3
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const r6 = 1.0-2.0*(r2+r4)
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struct IntrScheme{N, T}
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r::NTuple{N, T}
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eps::T
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ns::Int64
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end
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omf4(::Type{T}, eps, ns) where T = IntrScheme{6,T}((r1,r2,r3,r4,r5,r6), eps, ns)
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leapfrog(::Type{T}, eps, ns) where T = IntrScheme{2,T}((0.5,1.0,0.5), eps, ns)
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export IntrScheme, omf4, leapfrog
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end
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@ -16,6 +16,7 @@ using CUDA, Random, StructArrays
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using ..Space
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using ..Groups
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using ..Fields
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using ..MD
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import Base.show
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@ -48,14 +48,15 @@ function hamiltonian(mom, U, lp, gp, ymws)
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return K+V
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end
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function HMC!(U, eps, ns, lp::SpaceParm, gp::GaugeParm, ymws::YMworkspace; noacc=false)
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function HMC!(U, eps, ns, lp::SpaceParm, gp::GaugeParm, ymws::YMworkspace{T}; noacc=false) where T
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int = omf4(T, eps, ns)
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ymws.U1 .= U
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randomize!(ymws.mom, lp, ymws)
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hini = hamiltonian(ymws.mom, U, lp, gp, ymws)
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OMF4!(ymws.mom, U, eps, ns, lp, gp, ymws)
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MD!(ymws.mom, U, int, lp, gp, ymws)
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dh = hamiltonian(ymws.mom, U, lp, gp, ymws) - hini
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pacc = exp(-dh)
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@ -76,39 +77,29 @@ function HMC!(U, eps, ns, lp::SpaceParm, gp::GaugeParm, ymws::YMworkspace; noacc
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return dh, acc
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end
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function OMF4!(mom, U, eps, ns, lp::SpaceParm, gp::GaugeParm{T}, ymws::YMworkspace{T}) where T <: AbstractFloat
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function MD!(mom, U, int::IntrScheme{NI, T}, lp::SpaceParm, gp::GaugeParm{T}, ymws::YMworkspace{T}) where {NI, T <: AbstractFloat}
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r1::T = 0.08398315262876693
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r2::T = 0.2539785108410595
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r3::T = 0.6822365335719091
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r4::T = -0.03230286765269967
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r5::T = 0.5-r1-r3
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r6::T = 1.0-2.0*(r2+r4)
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ee = eps*gp.beta/gp.ng
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ee = int.eps*gp.beta/gp.ng
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force_gauge(ymws, U, gp.c0, lp)
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for i in 1:ns
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mom .= mom .+ (r1*ee) .* ymws.frc1
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U .= expm.(U, mom, eps*r2)
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mom .= mom .+ (int.r[1]*ee) .* ymws.frc1
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for i in 1:int.ns
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k = 2
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off = 1
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for j in 1:NI-1
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U .= expm.(U, mom, int.eps*int.r[k])
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if k == NI
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off = -1
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end
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k += off
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force_gauge(ymws, U, gp.c0, lp)
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mom .= mom .+ (r3*ee) .* ymws.frc1
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U .= expm.(U, mom, eps*r4)
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force_gauge(ymws, U, gp.c0, lp)
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mom .= mom .+ (r5*ee) .* ymws.frc1
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U .= expm.(U, mom, eps*r6)
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force_gauge(ymws, U, gp.c0, lp)
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mom .= mom .+ (r5*ee) .* ymws.frc1
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U .= expm.(U, mom, eps*r4)
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force_gauge(ymws, U, gp.c0, lp)
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mom .= mom .+ (r3*ee) .* ymws.frc1
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U .= expm.(U, mom, eps*r2)
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force_gauge(ymws, U, gp.c0, lp)
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mom .= mom .+ (r1*ee) .* ymws.frc1
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if (i < int.ns) && (k == 1)
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mom .= mom .+ (2*int.r[k]*ee) .* ymws.frc1
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else
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mom .= mom .+ (int.r[k]*ee) .* ymws.frc1
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end
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k += off
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end
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end
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return nothing
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