It was visible right after the calculations, but after saving it does not respond. When creating new reports, you simply show an empty field without a single hint of the graph
I found the problem. It turns out that you need a special way to save graphics
I am preparing the series of pyroxenes M1M2T2O6, changing the atom at T site. There are known pyroxenes with Li(Na)FeSi2O6, Ge can be as well at the T site. I would like to prepare Li(Na)FeSn2O6,...
10 August 2020 9,926 4 View
11 May 2017 2,696 2 View
I need to do CI calculation but without modifying molecular orbitals. I've tried to write iop(5/7=-1) but it didn't work. May you tell me what keyword I should use in this case? Thank you in advance.
03 April 2017 6,279 3 View
I began running IRC calculations from the optimized TS. Before starting irc I did frequency calculation which confirm that my Ts is stationary point and the first frequency is negative. But IRC...
29 November 2016 9,063 6 View
Hi, I am trying to construct a multi-layer fibril structure from a single layer in PyMol by translating the layer along the fibril axis. For now, I am able to use the Translate command in PyMol...
02 March 2021 4,569 4 View
I want to do a parameter study of a aixsymmetric cylinder in Abaqus. I want to create several jobs where I get the stresses for 3 different points in my model. These points are defined. I wrote a...
01 March 2021 10,078 1 View
Which is suitable for use with Python? MySQL or SQL Server? What is your suggestion?
01 March 2021 3,422 3 View
Please, if Gaussian Parameter optimization is possible in this code structure
28 February 2021 278 3 View
I wanted to add an extra parameter to the existing Johnson cook equation in the ABAQUS simulation. How to add those extra parameters. Ref: A modified Johnson-Cook material model with strain...
28 February 2021 4,841 3 View
The size of data generated by Ethovision is huge. Having NAS system for data storage seems to be a good option, I am wondering whether Ethovision can directly store the data to the NAS system...
27 February 2021 6,350 2 View
System Description Cuda 11.2 GeForce GTX 1080ti tensorflow version 2.4.1 keras version 2.2.0 python version 3.8 I was getting the below error when I try to run my code on the...
25 February 2021 6,673 2 View
23 February 2021 7,826 2 View
I am looking for implementation of bayesian decision trees and bayesian regression trees in Python and/or R.. Do you know if the existing libraries support this
23 February 2021 6,689 3 View
Hi everyone. I am researching droguht effects on soil water drought. I am looking for already implemented functions in R or Python to estimate soil water content from precipitation,...
21 February 2021 2,084 1 View