Show Posts

This section allows you to view all posts made by this member. Note that you can only see posts made in areas you currently have access to.


Topics - abhishek77492652

Pages: [1] 2 3 ... 5
1
General Questions and Answers / Dipole Transition probability
« on: September 5, 2019, 21:29 »
Dear sir,
How to calculate the dipole transition probability in Quantumwise ATK?

2
General Questions and Answers / Nanorod in Quantumwise-ATK
« on: June 8, 2019, 12:51 »
Dear Quantumwise team,
How to make the nanorod configuration of any material in quantumwise-ATK?

Thanks

3
General Questions and Answers / Supercell and unit cell
« on: January 29, 2019, 11:21 »
What is the difference between a unit cell and supercell?

4
General Questions and Answers / Electrochemical potential and fermi energy
« on: September 15, 2018, 19:13 »
What is the difference between fermi energy and electrochemical potential ?
According to Book Introduction to solid state physics (by Charles Kittel) at absolute zero the chemical potential is equal to the Fermi energy.

5
General Questions and Answers / Broadening of Fermi-Dirac Distribution
« on: August 25, 2018, 21:33 »
What is Broadening in Fermi-Dirac Distribution?

6
General Questions and Answers / Effect of Temperature on transmission spectrum
« on: August 25, 2018, 19:39 »
Dear Sir,

Can we calculate the temperature dependent Transmission spectrum in ATK?

Thanks

7
General Questions and Answers / Coupling between electrode and systems
« on: July 31, 2018, 08:40 »
Hello sir, currently i am working on temperature dependent spin transport of 2-d materials. While doing literature survey, i read some papers like : "Thermal spin transport properties based on VS2 monolayer: A first-principles study". But i got confused that how the system couple with the electrodes. Can any one clear my doubt?

8
General Questions and Answers / Spin-orbit -coupling parameter
« on: June 2, 2018, 19:18 »
Can we calculate the spin-orbit-coupling parameter of MoS2  by using VNL-ATK?

9
General Questions and Answers / Resistance calculation
« on: March 31, 2018, 15:56 »
How to calculate resistance or resistivity  of any material in vnl atk?

10
General Questions and Answers / Brillouin zone route in bandstructure calculation
« on: March 30, 2018, 19:05 »
Hello sir ,
I am calculating the bandstructure of hydrogenated graphene , but the brillouin zone route not remains same as the graphene. What i have to do to get same brillouin zone route? 
In case of hydrogenated graphene the brillouin zone route becomes (G, Z) instead of (G, M, K, G).

11
General Questions and Answers / Brillouin Zone Point in interfacing of Co2FeAl and monolayer MoS2
« on: March 20, 2018, 19:27 »
Hello sir
I am making the interface of Co2FeAl (001) and monolayer MoS2. When we are calculating the bandstructure of this interface we are not getting the M and K point in Brillouin Zone Route. What is the problem?
If we are calculating the bandstructure of MoS2 monolayer then the Brillouin Zone contain M and K point.
I have also preferred some paper in which they are showing the M and K point in the interface of Co /monolayer MoS2 and in the interface of  Ni/monolayer MoS2.
https://doi.org/10.1088/2053-1583/aa5a99     and   https://doi.org/10.1103/PhysRevB.95.075402

12
General Questions and Answers / Super cell and Unit cell
« on: March 3, 2018, 04:13 »
what is the difference between unit cell and super cell ?

13
General Questions and Answers / Cif file
« on: March 2, 2018, 17:47 »
Can any one provide me the cif file of B2 (partial order) and A2 (fully disorder) structure of Co2FeAl ?

14
General Questions and Answers / Heterojunction of two dimensional materials
« on: February 2, 2018, 14:32 »
How we can make hetero-junction of  graphene and Boron nitride in VNL-ATK?

15
General Questions and Answers / Phosphorene Nanotube
« on: January 14, 2018, 18:58 »
Hi Sir,

How to make phosphorene  armchair and zigzag SWNT. Please provide tutorial.

Regards,
Vinayak Musle

Pages: [1] 2 3 ... 5