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

After a reference from Int J Body Compos Res, can any body help?

Hi, I am after the reference below, my library says it cannot obtain a copy either locally or internationally, any help appreciated! Chris Wang ZM, Heshka S, Wielopolski L, Pi-Sunyer FX, Pierson...

03 March 2021 6,193 1 View

Irradiation data for JAPAN?

Hi, Could you help me to get the latest (2019, 2020) solar resource data for a particular site in JAPAN? PV GIS and NSRDB data are not in reach to JAPAN, I'm looking for some other database for...

03 March 2021 961 3 View

How to calculate Ligand-active site distance in a ligand-protein complex from MD simulation?

I have run a MD simulation of a ligand-protein complex in GROMACS using CHARMM forcefield. Reviewer has asked me to calculate Ligand-activesite distance and binding free energy of ligand with...

27 February 2021 4,703 1 View

Why do the air flow results vary totally when adding scalar in CFD ?

Dear All, We are using Autodesk cfd to calculate the air flow in a single sided naturally ventilated room, where air flow depends only on buoyancy due to temperature difference between inside and...

25 February 2021 9,602 4 View

How to model Supercritical water gasification (SCWG) process in Homer software?

Hi everyone How to model Supercritical water gasification (SCWG) process in Homer software?

25 February 2021 4,075 1 View

Steps to calculate activation energy by coats & redfern method?

I'm a chemistry student and I'm researching the kinetic degradation of mixed plastic waste. I'm having trouble calculating the activation energy by the coats & Redfern method. The data that...

24 February 2021 974 1 View

Is it possible to define biogas as a fuel in the reformer process(scwg) in Homer software?

Hi every one Is it possible to define biogas as a fuel in the reformer process(scwg) in Homer software? Biogas fuel is not available in the options thanks

23 February 2021 6,518 3 View

Are there any candidates for an Einstein's bare cosmological constant?

It is commonly accepted that General Relativity has its own 'bare' cosmological constant that contributes together with the cosmological constant resulting from vacuum energy density for an...

23 February 2021 5,448 8 View

How to dissolve cross-linked Amberlite IRC120 H, hydrogen form resin?

Hello all, I have used Amberlite IRC120 H, hydrogen form acidic cation-exchange resin for the ion-exchange of waterglass [sodium silicate solution -- 40% Sodium silicate (mol ratio > 3.2)...

21 February 2021 5,614 3 View

How to resolve Gaussian error termination " Error termination via Lnk1e in F:\G16W\l103.exe" for TS(QST3)?

When I run the job for TS(QST3) in gaseous phase, it was completed without any error. But when I add water in CPCM model it terminated with an error: Inconsistency: ModMin= 2 Eigenvalue=...

21 February 2021 3,198 2 View