Federico Verdicchio

5 Questions 1 Answers 0 Followers

Questions related from Federico Verdicchio

Lignin molecule calculation using Quantum Espresso?

Hello everyone, I need to calculate some properties of the lignin molecule (likely using a simplified model of lignin). I have access to a server with Quantum Espresso. Would it be feasible to...

13 September 2024 3,581 0 View

How to solve Quantum Espresso 7.3 Compilation Error ?

Hello everyone, I'm pretty new to QE and Unix environment in general. Wanting to explore QE I downloaded the source code from their site. The configuration was successfuls but when trying to...

14 February 2024 432 1 View

Unsubstracted heat flow on STA6000 using Pyris software?

Some time ago I ran a TGA/DSC analysis of a polymer sample. Among the obtained data there is the "unsubtracted heat flow (mW)", now my doubt is if the "unsubtracted" is referred to the weight of...

07 May 2020 3,730 0 View

Can I use a rotational rheometer to compare the propeties of a granular thermoplastic with its injection-moulded product?

If a problem in a molded product occurs, is it possible to correlate the (rotational) rheological data of that specific sample with the data obtained from the virgin granules of the materials?

03 March 2020 3,240 5 View

VASP alternatives and teaching

Hello everyone! I'm about to start a research grant on energy storage materials. The first task is to replicate the results of a paper where they used DFT and MD calculations (with VASP) to...

01 January 1970 675 3 View