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al.dispersions.ps
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn0
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New code to compute total energy and phonons in 2D materials by enforcing 2D periodic boundary conditions. Inter-layer Coulomb interaction is truncated. Vacuum space need to be larger than the layer size. Also check phonon example17 and input documentation.
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2017-10-25 10:40:59 +00:00 |
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bn.disp.dyn1
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn2
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn3
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn4
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn5
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn6
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn7
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn8
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn9
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.disp.dyn10
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.freq
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.freq.gp
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.ph.disp.in
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.ph.disp.out
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.scf.in
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn.scf.out
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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bn881.fc
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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freq.disp.plot
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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freq.disp.ps
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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matdyn.in
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New code to compute total energy and phonons in 2D materials by enforcing 2D periodic boundary conditions. Inter-layer Coulomb interaction is truncated. Vacuum space need to be larger than the layer size. Also check phonon example17 and input documentation.
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2017-10-25 10:40:59 +00:00 |
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matdyn.modes
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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matdyn.out
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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plotband.in
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New code to compute total energy and phonons in 2D materials by enforcing 2D periodic boundary conditions. Inter-layer Coulomb interaction is truncated. Vacuum space need to be larger than the layer size. Also check phonon example17 and input documentation.
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2017-10-25 10:40:59 +00:00 |
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q2r.in
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New code to compute total energy and phonons in 2D materials by enforcing 2D periodic boundary conditions. Inter-layer Coulomb interaction is truncated. Vacuum space need to be larger than the layer size. Also check phonon example17 and input documentation.
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2017-10-25 10:40:59 +00:00 |
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q2r.out
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Example updated to use standard pseudo from quantum-espresso.org instead of one from theos
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2017-10-26 07:06:05 +00:00 |
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