how can we make two dimensional materials (monolayer). I am new in this . please suggest me some software
hi i am running scf calculation of PbSb two dimensional material. this is semiconductor. while running scf calculation i am getting this error. Self-consistent Calculation iteration # ...
07 August 2018 5,116 1 View
Dear All, I need some clarifications regarding strain application in graphene. While applying uniaxial strain, do I need to maintain area same ? Also, is it necessary to take into...
06 July 2018 7,773 0 View
anybody help me to find effective mass with temperature by using DFT?
08 September 2016 1,229 2 View
Hello experts, Does anyone know any free software about retention index prediction ?
08 August 2024 7,403 2 View
Molecular docking software/ websites?
02 August 2024 8,704 7 View
Hi all, may I ask you for advice about treating monolayer culture cell line with essential oil. Due to the hydrophobic character of the oil, I am concerning how can it equally affect to all the...
31 July 2024 5,301 2 View
I created a file with my outgroup and ingroup species using Beauti, ran it in BEAST, viewed it in Tracer, and then used TreeAnnotator to create a file that I imported into RASP. Could someone...
28 July 2024 2,979 1 View
I am reaching out to seek your valuable advice and recommendations regarding the best software tools to use for this research. Specifically, I am looking for software with a user-friendly...
22 July 2024 3,794 1 View
Hey all, I need help testing for multivariate outliers using STATA for my master thesis. The literature recommends the Minimum Covariance Determinant (MCD) (Verardi & Dehon, 2010). I found the...
22 July 2024 8,821 2 View
Dear Researchers, My question is associated with the "MDCI" method in Orca. Please let me clarify my question using a simple example: Suppose we are going to perform CBS extrapolation using "!...
21 July 2024 1,632 0 View
im studing gaussian 16 with reading paper about I-131 Metaiodobenzylguanidine in the paper "In a similar vein, nuclear magnetic resonance shielding values were investigated using the widely...
16 July 2024 6,040 4 View
Hi all, Do you know how to plot this figure? I found many of them in Nature journals but have not figured out how to make them. Which software/tool do you suggest? Thank you very much.
15 July 2024 8,384 2 View
How can novel network architectures, such as software-defined networking (SDN) and network function virtualization (NFV), contribute to improved handover performance and reduced latency in future...
12 July 2024 6,183 1 View