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Compute coord/atom orientorder threshold
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1
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194
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March 23, 2023
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How to calculate heat flow along a certain direcion in EMD? (We are looking at difference of using primitive cell or conventional to get thermal conductivity by kubo formular)
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2
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225
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March 23, 2023
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Adding a repulsive correction at short distances to Buckingham potential
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5
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476
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March 23, 2023
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Compute Stress/Atom with nanoparticle(rigid)
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1
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253
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March 23, 2023
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Unused restart file global fix info
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4
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537
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March 22, 2023
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Can we calculate surface potential in LAMMPS?
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1
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374
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March 22, 2023
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How to call the Number of atoms in a dump file using pizza.py?
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7
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261
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March 22, 2023
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Npt/nvt equilibration problem
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12
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815
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March 22, 2023
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Arrhenius equation in fix bond/react command
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11
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886
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March 22, 2023
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Attach polymer in a 2D surface
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5
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360
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March 21, 2023
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XRD Command
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2
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193
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March 22, 2023
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Colvars:distanceZ, does the force generated by the spring act on both the "main" and "ref" atoms？
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7
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352
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March 21, 2023
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Interaction Energy between particles
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7
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379
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March 20, 2023
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Including heat transfer in MD simulation
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1
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239
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March 20, 2023
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Virtual site - only bonding interactions needed
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1
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185
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March 20, 2023
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Kinetic energy filter surface
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10
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330
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March 20, 2023
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Any differences between "fix press/berendsen command"; "fix box/relax command" and "fix deform with fix nph together" if i want to reach a isotropic compression stage
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3
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342
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March 20, 2023
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Dipole Moment
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1
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633
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March 19, 2023
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Post_calculation of average stress in xx, yy and zz
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4
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353
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March 18, 2023
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Pressures for a fixed free surface in a vaccuum
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1
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181
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March 17, 2023
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Incorrect args for pair coefficients with Tersoff+LJ
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1
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217
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March 16, 2023
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Statistics of bonds under the Reaxff
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1
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248
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March 16, 2023
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Error using centroid/stress/atom
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3
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295
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March 15, 2023
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Simulating bulk fluid between two walls
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11
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1617
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March 15, 2023
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How to increase the box dimension along any direction during simulation
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5
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247
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March 15, 2023
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Coarsw grain model of polymer
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1
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225
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March 15, 2023
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Stop printing the output information to the screen of the terminal while using lammps
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2
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267
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March 14, 2023
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Problem in LAMMPS-ReaxFF
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2
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463
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March 14, 2023
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Run every command
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2
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332
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March 14, 2023
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Reaxff/species with elimination based on mass limit
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4
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293
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March 14, 2023
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