How can I get the Voronoi Integral in DFT calculation using Gaussian 09?

Started by adhikary | Last post by adhikary August 24, 2017, 04:43:15 AM

A problem occurs during QST2 calculation-Any solution available?

Started by adhikary | Last post by adhikary June 24, 2020, 09:20:43 PM

calculation Band Gap of a Semiconducting material using Theoretical basis

Started by adhikary | Last post by Enthalpy June 11, 2015, 05:44:36 AM

What does it mean ? How can I solve the problem? {Gaussian 09}

Started by adhikary | Last post by adhikary June 26, 2014, 03:14:50 AM

How the energy of Universe is constant if the entropy of it increases?

Started by adianadiadi | Last post by Juan R. February 22, 2011, 02:30:16 PM

Confusion with fraction on Y axis

Started by AdiDex | Last post by mjc123 November 24, 2015, 04:49:25 AM

Sign Confusion , please fast

Started by AdiDex | Last post by mjc123 December 09, 2016, 05:27:26 AM

Curiosity : why Infrared means heat to human ?

Started by AdiDex | Last post by Corribus August 19, 2015, 10:25:22 AM

Understanding Electron Back Scattered Data

Started by AdiDex | Last post by AdiDex October 23, 2018, 01:47:47 AM

Tungsten's Vapor pressure

Started by AdiDex | Last post by AdiDex October 02, 2016, 03:35:07 AM

Physical Significance of this integral

Started by AdiDex | Last post by AdiDex November 09, 2018, 04:58:50 PM

Relation between deliquescence and vapor pressure

Started by AdiDex | Last post by Borek October 15, 2016, 04:26:35 PM

Real gases

Started by AdiDex | Last post by Enthalpy September 27, 2015, 07:21:11 PM

Is it possible to calculate the momentum of an electron precisely?

Started by AdiDex | Last post by Enthalpy February 08, 2018, 01:30:34 PM

How to find out whether the electrolyte is strong/weak?

Started by ador11 | Last post by Borek November 17, 2012, 06:36:26 AM