All questions asked by Shekhar Shrestha

List all solved & unsolved questions asked by Shekhar Shrestha

Delegation the Tezos to the staking team through Trust wallet. I have following question. Please help

1 Tezos Asked on 08/19/2021

Is there an anisotropy factor (g factor) for TDDFT absorption and circular dichroism calculations?

1 Matter Modeling Asked on 12/20/2021

density functional theory from phys se quantum chemistry spectroscopy td dft

Why am I losing bonds when I use PACKMOL on two proteins?

1 Matter Modeling Asked on 12/20/2021

covid 19 docking molecular dynamics software

Can we "invert" Density Functional Theory through sufficiently accurate experiment?

1 Matter Modeling Asked on 12/18/2021

condensed matter density functional theory from phys se

How do you calculate the "true" chemical potential in classical density functional theory?

1 Matter Modeling Asked on 12/16/2021

density functional theory from phys se mathematical modeling statistical thermodynamics variational principle

Converging the potential of a dilute binary alloy system using the Coherent Potential Approximation. What troubleshooting options could I take?

1 Matter Modeling Asked on 12/16/2021

alloys density functional theory from phys se relativistic software

The Hund's J - Why can this be quantified?

1 Matter Modeling Asked on 12/16/2021

density functional theory from phys se hubbard model

How accurate are the most accurate calculations?

1 Matter Modeling Asked on 12/13/2021

atomic physics full configuration interaction high precision molecular modeling periodic system

Is there any software that can generate the electronic DOS of GaAs?

1 Matter Modeling Asked on 12/13/2021

band structure density functional theory from phys se quantum espresso

Which Linux distribution is best for Matter Modeling?

9 Matter Modeling Asked on 12/11/2021

high performance computing matter modeling specific technology one topic per answer open source software

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