If the lowest unoccupied orbital is considered in organic photovoltaic solar cell?

Dear people, I am confused about LUMO orbitals in photovoltaic solar cells. According to the literature, Voc (open circuit voltage) is related to the HOMO orbital of donor and LUMO orbital of...

16 August 2020 1,538 4 View

How to sure that a optimized structure is traped in a global potential well not in the local one for large systems?

Dear people, I have optimized a dimer (each monomer contains about 50 to 60 atoms) structure in its equilibrium distances (I have done a rigid scan to find the equilibrium distance between...

05 August 2020 7,683 1 View

How to calculate the Jsc for solar cell?

Dear all, I need to calculate the amount of Jsc for solar cell using quantum mechanics approach. As the Jsc is the integration of the Air mass spectrum, is it possible to calculate it according...

30 November 2019 5,411 2 View

Phycoerythrin from two Nostoc strains SDS-PAGE?

Dear colleagues We could successfully extract and purify the Phycoerythrin from two Nostoc strains with four major steps viz. preparation of crude extract (Step I), 65% ammonium sulfate...

16 July 2018 1,264 7 View

How to compute error rates for a cascade verification system?

13 September 2016 3,017 3 View

Does anyone know that why some of filaments of spirulina are in red and some of them are blue at the same slide?

Hi every one Recently we bought some permanent microscopic slide of different species of cyanobacteria. I have a question about the slide of spirulina. Does anyone know that why some of filaments...

22 August 2016 9,099 6 View

How does the solvent affect the molecular weight of polymer?

19 December 2014 5,754 7 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

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

Chlorinated organic formation in odor control scrubbers using hypochlorite?

I'm involved in a study of odor control technologies for municipal wastewater treatment plant. One of the control options involves a chemical 2-stage (acid/alkaline) packed bed scrubber. The...

03 March 2021 3,661 2 View

Arena simulation - how do i model the following model in ARENA (see description) (new to ARENA)?

Hello, I'm fairly new to ARENA and I have the following problem: I have two queues in which, in each queue, a different order type arrives (both having an arrival rate of exponential 10). Order...

02 March 2021 2,431 3 View

Why are the velocities so high in my Boussinesq approximation Fluent simulation?

Hello, I have a mechanism where air rises due to convective flows. In this simulation, nothing is driving the air except this. I understand that the Boussinesq approximation only works for small...

02 March 2021 4,910 3 View