tag:joss.theoj.org,2005:/papers/tagged/electron%20densityJournal of Open Source Software2023-07-06T12:21:33ZJournal of Open Source Softwarehttps://joss.theoj.orgtag:joss.theoj.org,2005:Paper/43952023-07-06T12:21:33Z2023-07-07T00:01:19ZEDP: a program for projecting electron densities from VASP onto planesacceptedv2.0.02023-04-12 12:37:00 UTC872023-07-06 12:21:33 UTC820235417I.a.w.FilotInorganic Materials and Catalysis, Department of Chemical Engineering and Chemistry, Eindhoven University of Technology0000-0003-1403-837910.21105/joss.05417https://doi.org/10.5281/zenodo.8104498Python, C++https://joss.theoj.org/papers/10.21105/joss.05417.pdfElectron density, Charge density, VASP, Projectiontag:joss.theoj.org,2005:Paper/20602021-01-07T22:06:36Z2021-12-27T17:54:04ZGIMS: Graphical Interface for Materials Simulationsaccepted1.0.02020-10-06 15:26:57 UTC572021-01-07 22:06:36 UTC620212767SebastianKokottThe NOMAD Laboratory at the Fritz Haber Institute of the Max Planck Society, Berlin, Germany0000-0003-1066-6909IkerHurtadoThe NOMAD Laboratory at the Fritz Haber Institute of the Max Planck Society, Berlin, Germany0000-0003-3805-4912ChristianVorwerkInstitut für Physik and IRIS Adlershof, Humboldt-Universität zu Berlin, Berlin, Germany0000-0002-2516-9553ClaudiaDraxlInstitut für Physik and IRIS Adlershof, Humboldt-Universität zu Berlin, Berlin, Germany0000-0003-3523-6657VolkerBlumDepartment of Mechanical Engineering and Materials Science, Duke University, Durham, NC, United States of America0000-0001-8660-7230MatthiasSchefflerThe NOMAD Laboratory at the Fritz Haber Institute of the Max Planck Society, Berlin, Germany0000-0002-1280-987310.21105/joss.02767https://doi.org/10.5281/zenodo.4386436Python, JavaScripthttps://joss.theoj.org/papers/10.21105/joss.02767.pdfComputational Materials Science, Electronic Structure Theory, Density Functional Theorytag:joss.theoj.org,2005:Paper/15392020-03-30T20:54:47Z2021-02-15T11:30:55ZPyZFS: A Python package for first-principles calculations of zero-field splitting tensorsacceptedv1.02020-03-02 20:58:13 UTC472020-03-30 20:54:47 UTC520202160HeMaDepartment of Chemistry, University of Chicago, Chicago, IL 60637, USA, Materials Science Division and Center for Molecular Engineering, Argonne National Laboratory, Lemont, IL 60439, USA0000-0001-8987-8562MarcoGovoniMaterials Science Division and Center for Molecular Engineering, Argonne National Laboratory, Lemont, IL 60439, USA, Pritzker School of Molecular Engineering, University of Chicago, Chicago, IL 60637, USA0000-0001-6303-2403GiuliaGalliDepartment of Chemistry, University of Chicago, Chicago, IL 60637, USA, Pritzker School of Molecular Engineering, University of Chicago, Chicago, IL 60637, USA, Materials Science Division and Center for Molecular Engineering, Argonne National Laboratory, Lemont, IL 60439, USA0000-0002-8001-529010.21105/joss.02160https://doi.org/10.5281/zenodo.3728346Pythonhttps://joss.theoj.org/papers/10.21105/joss.02160.pdfmaterials science, electron spin, zero field splitting, density functional theory, point defectstag:joss.theoj.org,2005:Paper/2392017-10-15T00:00:00Z2021-02-15T11:34:00ZUglyMol: a WebGL macromolecular viewer focused on the electron densityacceptedv0.5.72017-07-20 09:14:02 UTC182017-10-15 00:00:00 UTC22017350MarcinWojdyrDiamond Light Source Ltd, Harwell Campus, Didcot, OX11 0DE, UK, Global Phasing Ltd, Sheraton House, Cambridge, CB3 0AX, UK0000-0003-3980-409210.21105/joss.00350https://doi.org/10.5281/zenodo.1009695JavaScripthttps://joss.theoj.org/papers/10.21105/joss.00350.pdfprotein structure visualization, electron density, WebGL