What makes pressure an intensive variable?

Can you give a qualitative explanation.

01 February 2018 7,194 0 View

What is the difference between potential and potential energy?

How do you represent it mathematically?

09 October 2017 9,937 2 View

At what temperature does the Born-Oppenheimer approximation fail (for an H atom)?

Is there a mathematical framework to answer this question?

08 September 2017 497 2 View

Can the mass ratio of electron to proton (nucleus) change w.r.t. change in temperature, for an H atom?

The ratio is ideally ~1 : 1836. At what temperature does it fall to 1 : 1800?

08 September 2017 3,705 3 View

Shouldn't "heat gradient" be the driving force for heat flow rather than "temperature gradient"?

31 December 2015 894 5 View

In the synthesis of nanoparticles by the coprecipitation method, particles precipitate and are vividly visible. How can we actually see nanoparticles?

11 December 2015 3,591 8 View

[VASP] Relaxation in Steps.

Is it alright if I run an ISIF = 3 and ISPIN = 2 calculation for 2 hours, after which the job terminates (limited computing resources), and then simply copy the CONTCAR to POSCAR and start it...

01 January 1970 3,513 7 View

error in running a model in Abaqus

Excessive rotation of nodes in node set ErrNodeExcessRotation-Step1

17 August 2021 0 0 View

error in modelling model in Abaqus

Excessive rotation of nodes in node set ErrNodeExcessRotation-Step1

17 August 2021 0 0 View

MD MOE RMSD

How to calculate the RMSD values for a MD simulation using MOE?

07 August 2021 0 0 View

MD MOE RMSD

How to calculate the RMSD values for a MD simulation using MOE?

07 August 2021 0 0 View

MGL tools

20 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

fatal error

When I tried to energy minimization my system, I got fatal error as below. Fatal error: Atomtype opls_116 not found Although I've already added this line: ; include water #include "oplsaa.ff/spc.itp" to [molecultype] directive in my topology.

16 June 2021 0 0 View

How climate change will influences human and animal behavioral change?

The role of climate change influencing the human behavior as well as economics interest

01 June 2021 0 0 View