A generalized noise-cancellation approach computes finite-temperature elastic constants with reduced thermal noise by differencing stresses from identically thermostatted strained and reference simulations across crystalline, amorphous, and polymer systems.
Isothermal elas- tic constants for argon. theory and monte carlo calcula- tions,
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Computing finite--temperature elastic constants with noise cancellation
A generalized noise-cancellation approach computes finite-temperature elastic constants with reduced thermal noise by differencing stresses from identically thermostatted strained and reference simulations across crystalline, amorphous, and polymer systems.