24 October 2023 0 3K Report

I have been using PySCF to obtain the two-particle density matrix from a ccsd(t) calculation. However, the calculation is not so memory efficient. But, one can obtain, store ,and manipulate the matrix elements (obtained from PySCF) as an array.

Are there any other computational chemistry packages that offer the same (or even similar)?

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Hello everyone. my question is why electric vehicle need reactive power and sometimes EV also provide reactive power support to grid.Explain how?

many literature talked about reactive power support to EV by distribution grid and vice versa. But EV load is nothing but charging a battery, which is a pure DC load or source.

07 March 2020 6,787 3 View

I am performing PSHa analysis of a stable continent in R-Crisis. Details of modelling explained below. Why I am getting such a high value of PGA?

I am doing psha analysis of a site in Indian peninsular region using R-crisis software. I have devided the site with various seismic zones. Maximum credible earthquake is 6.8. I have calculated a...

21 February 2020 9,828 7 View

What are the disadvantages of enrichment design in a randomised control trial for a new drug ?

Enrichment design in a clinical trial to evaluate efficacy and safety of a new investigational product

16 January 2020 4,836 3 View

Is there any type citation of Ormosia fordiana Oliv.?

I am interested to know if there is any type citation of this name in Fl. Cambodge, Laos & Vietnam in vol. 23 (1987). If cited, then how it is cited?

11 January 2020 460 1 View

How can electrostatic energy becomes positve while the total energy is negative in LMOEDA?

I my study of intermolecular non-covalent complexes, I have used LMO-EDA by GAMESS codes to find the seperate contributions of energy terms. In a strange finding, I observed that although total...

23 November 2019 7,396 9 View

For addressing the present research question, using thematic analysis, must I aim for an equal sample size?

Dear fellow researchers, I am a novice when it comes to qualitative methodology. Although I have gone through the article of Braun and Clarke (2006), and referred to a number of other resources,...

09 November 2019 300 8 View

How can determine the Quantity of liquid desiccant for air dehumidification system? Required Temperature for Regeneration??

Liquid Desiccant air dehumidification System Design with regeneration

24 June 2019 2,341 1 View

What is the purpose of a Lab in Research Gate?

From time to time I get messages containing information that my name has been included in a Lab. No offer is sent before this inclusion. It is never asked that whether I am interested in working...

30 June 2018 4,068 20 View

Have you seen the attached publication?

On UGC approved list of journals

25 March 2018 2,308 4 View

I want to correlate two variables with different sample size. What will be the procedure ?

Group A with n1 sample size has rated variable V1 ( performance of Group B ) Group B with n2 sample size has rated variable V2 ( governance of the institution) Now I want to correlate V1 with V2 .

17 March 2018 7,384 4 View

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