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Simulating/analyzing new shape/structure in VMD and LAMMPS
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1
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359
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March 12, 2023
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How LAMMPS calculate the denisty of simulation box
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2
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229
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March 12, 2023
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"compute dipole" for TIP4P water models
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5
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420
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March 12, 2023
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How to solve Neighbor list builds = 1 Dangerous builds not checked?
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4
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758
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March 12, 2023
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TIP4P/2005 under electric field
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7
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436
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March 12, 2023
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What thermodynamic conditions data gathering run considers
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5
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256
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March 11, 2023
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Tip4p
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1
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240
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March 11, 2023
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SPH atom stop after touching walls
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2
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251
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March 11, 2023
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Using fix shake with minimization
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3
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542
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March 11, 2023
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Rotational diffusion of Active BROWNIAN PARTICLES
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3
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568
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March 11, 2023
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Small differences in calculation results using read_restart command with different CPU cores
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1
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180
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March 11, 2023
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Solid-liquid interface
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10
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1304
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March 11, 2023
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Compute inter all inter
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3
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324
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March 10, 2023
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Getting error trying to run MC examples in lammps
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5
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446
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March 10, 2023
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LAMMPS/Kokkos: Performance discrepancy between src-built binary and NGC container
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5
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379
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March 10, 2023
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Invalid force field file format?
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4
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473
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March 9, 2023
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Methods provided by PLUMED for LAMMPS
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2
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519
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March 9, 2023
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How to calculate the adsorption capacity at the MD process
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3
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225
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March 9, 2023
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Incorrect generation of structure?
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4
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243
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March 9, 2023
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SPC/E water slab under electric field
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6
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551
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March 8, 2023
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How to caculate the Td from Norgett–Robinson–Torrens (NRT) model
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4
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349
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March 8, 2023
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Partial charge & Formal charge
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2
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280
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March 8, 2023
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Returning an array using the LAMMPS python+variable commands?
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2
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682
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March 7, 2023
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A problem with fix nve
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5
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193
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March 7, 2023
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Problem with rigid body dynamics
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6
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514
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March 7, 2023
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To be more specific while calculation of MSD
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1
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308
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March 6, 2023
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Problems with fix print
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7
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744
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March 5, 2023
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Data generator tool for ternary system
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1
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206
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March 4, 2023
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Converting multiple restart file to their respective data files
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2
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211
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March 4, 2023
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Question about running a diffusion simulation code using a structure generated after initial NPT and NVT equilibration
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1
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302
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March 4, 2023
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