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Enabling multiple exchange interactions
This commit is contained in:
julient31
2018-04-16 09:02:16 -06:00
parent 8709f6044b
commit ce80d1a3ea
26 changed files with 2124 additions and 1340 deletions
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13
doc/src/pair_spin_soc_dmi.txt → doc/src/pair_spin_dmi.txt
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@ -6,11 +6,11 @@
:line
pair_style pair/spin/soc/dmi command :h3
pair_style pair/spin/dmi command :h3
[Syntax:]
pair_style pair/spin/soc/dmi cutoff :pre
pair_style pair/spin/dmi cutoff :pre
cutoff = global cutoff pair (distance in metal units) :ulb,l
@ -18,19 +18,16 @@ cutoff = global cutoff pair (distance in metal units) :ulb,l
[Examples:]
pair_style pair/spin/soc/dmi 4.0
pair_style pair/spin/dmi 4.0
pair_coeff * * dmi 2.6 0.001 1.0 0.0 0.0
pair_coeff 1 2 dmi 4.0 0.00109 0.0 0.0 1.0 :pre
[Description:]
Styles {pair/spin/soc} compute pair interactions arising from the spin-orbit
coupling (soc).
Style {pair/spin/soc/dmi} computes the Dzyaloshinskii-Moriya (DM) interaction
Style {pair/spin/dmi} computes the Dzyaloshinskii-Moriya (DM) interaction
between pairs of magnetic spins:
:c,image(Eqs/pair_spin_soc_dmi_interaction.jpg)
:c,image(Eqs/pair_spin_dmi_interaction.jpg)
where si and sj are two neighboring magnetic spins of two particles,
rij = ri - rj is the inter-atomic distance between the two particles,

13
doc/src/pair_spin_soc_neel.txt → doc/src/pair_spin_neel.txt
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@ -6,11 +6,11 @@
:line
pair_style pair/spin/soc/neel command :h3
pair_style pair/spin/neel command :h3
[Syntax:]
pair_style pair/spin/soc/neel cutoff :pre
pair_style pair/spin/neel cutoff :pre
cutoff = global cutoff pair (distance in metal units) :ulb,l
@ -18,19 +18,16 @@ cutoff = global cutoff pair (distance in metal units) :ulb,l
[Examples:]
pair_style pair/spin/soc/neel 4.0
pair_style pair/spin/neel 4.0
pair_coeff * * neel 4.0 0.0048 0.234 1.168 2.6905 0.705 0.652
pair_coeff 1 2 neel 4.0 0.0048 0.234 1.168 0.0 0.0 1.0 :pre
[Description:]
Styles {pair/spin/soc} compute pair interactions arising from the spin-orbit
coupling (soc).
Style {pair/spin/soc/neel} computes the Neel pair anisotropy model
Style {pair/spin/neel} computes the Neel pair anisotropy model
between pairs of magnetic spins:
:c,image(Eqs/pair_spin_soc_dmi_interaction.jpg)
:c,image(Eqs/pair_spin_dmi_interaction.jpg)
where si and sj are two neighboring magnetic spins of two particles,
rij = ri - rj is the inter-atomic distance between the two particles,