How to write an input file to perform SCS MP2 calculation on Gaussian?

Your response is very appreciated.

06 July 2018 2,975 3 View

What is your successful method of teaching?

Among different methods for teaching, which method do you find effective?

01 February 2018 3,260 43 View

What is the major reason behind humans' superiority?

Human's brain/mind or human's hands or language: which one is the decisive factor that makes humans superior to other animals? Thanks in advance for your opinion

31 December 2017 6,094 12 View

Why do we sleep? what science tells us about the need for sleep?

31 December 2017 3,953 23 View

Is Ignorance Bliss?

31 December 2017 1,347 21 View

What are the reasons behind the following Gaussian 16 error?

I have the following error running doublet molecule using M062X\6-31G(d): Annihilation of the first spin contaminant: S**2 before annihilation 0.7554, after 0.7500 Convergence failure...

11 December 2017 7,946 4 View

What is your favorite and most inspiring quote ever?

Quotes that are written well can leave a profound impact on people. They may give hope and courage to continue and can help to see light at the end of the tunnel. One of my favorite quotes ever...

11 December 2017 2,559 58 View

What are the recommended DFT methods to study chemical reactions involving free radicals?

11 December 2017 5,547 10 View

What are the advantages and disadvantages of artificial intelligence?

From your point of view, what are the benefits and risks of robots, artificial intelligence, and machine learning? What worries you about the arriving era of artificial intelligence? Dear reader,...

11 December 2017 4,059 66 View

When applying to academic job, does impact factors of journals I published in matter?

Is it true that if you've published your work in high impact factor journals then your chance of getting a good academic job is also high?

11 December 2017 1,990 27 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

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

flexibility of polymers chain

effect of double bond on the flexibility of polymers

07 April 2021 0 0 View

Formulation of polymer color flakes

I am writing to request some information for making polymer color flakes. I would appreciate the help.

17 March 2021 0 0 View

What kind of fluid could I use for a pitfall trap that also does not invalidate molecular testing?

Hi, I want to start testing pitfall trap to obtain ants samples, but I need to conduct molecular analysis on those insects. So, what kind of fluid can I use? Ethanol expires too early and I need...

03 March 2021 5,978 5 View

Resistor definition in Piezoelectric bimorph with ANSYS workbench

Hello, good day! I am trying to simulate similar bimorph piezoelectric harvester with below commands. However, the output power doesn't change with resistor value. Please help to find the reason. ET,10,CIRCU94,0 !SET UP RESISTOR R,1,100000 !RESISTANCE VALUE TYPE,10 !SET ELEMENT TYPE E,1,2 !CREATE RESISTOR BETWEEN NODES 1 AND 2 Thanks in advance Regards,

02 March 2021 0 0 View