tag:joss.theoj.org,2005:/papers/reviewed_by/@govarguzJournal of Open Source Software2022-12-23T18:24:34ZJournal of Open Source Softwarehttps://joss.theoj.orgtag:joss.theoj.org,2005:Paper/39072022-12-23T18:24:34Z2022-12-24T00:00:58ZGLUE Code: A framework handling communication and interfaces between scalesacceptedv1.0.02022-09-20 21:01:36 UTC802022-12-23 18:24:34 UTC720224822AleksandraPachalievaCenter for Non-Linear Studies, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA, Earth and Environmental Sciences (EES) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0003-1246-0410RobertS.PavelComputer, Computational and Statistical Sciences (CCS) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0001-7913-9918JavierE.SantosCenter for Non-Linear Studies, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA, Earth and Environmental Sciences (EES) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0002-2404-3975AbdourahmaneDiawFusion Energy Division, Oak Ridge National Laboratory, 1 Bethel Valley Road, Oak Ridge, TN 37831, USA0000-0001-6743-3255NicholasLubbersComputer, Computational and Statistical Sciences (CCS) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0002-9001-9973MohamedMehanaEarth and Environmental Sciences (EES) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0003-2472-2879JeffreyR.HaackComputer, Computational and Statistical Sciences (CCS) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0002-2044-0885HariS.ViswanathanEarth and Environmental Sciences (EES) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0002-1178-9647DanielLivescuComputer, Computational and Statistical Sciences (CCS) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0003-2367-1547TimothyC.GermannTheoretical Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0002-6813-238XChristophJunghansComputer, Computational and Statistical Sciences (CCS) Division, Los Alamos National Laboratory, Los Alamos, 87545 NM, USA0000-0003-0925-145810.21105/joss.04822https://doi.org/10.5281/zenodo.7469110Fortran, C++, C, Pythonhttps://joss.theoj.org/papers/10.21105/joss.04822.pdfmultiscale simulations, active machine leanring, scale-bridging, ICF, MDtag:joss.theoj.org,2005:Paper/30002021-11-08T15:33:55Z2021-11-09T00:01:33Zpartycls: A Python package for structural clusteringacceptedv1.0.02021-08-27 12:02:52 UTC672021-11-08 15:33:55 UTC620213723JorisParetLaboratoire Charles Coulomb (L2C), Université de Montpellier, CNRS, Montpellier, France0000-0002-1300-1227DanieleCoslovichDipartimento di Fisica, Università di Trieste, Italy10.21105/joss.03723https://doi.org/10.5281/zenodo.5639407Python, Fortranhttps://joss.theoj.org/papers/10.21105/joss.03723.pdfclustering, structure, condensed matter, physicstag:joss.theoj.org,2005:Paper/18212020-10-27T16:27:51Z2021-02-15T11:30:22ZELECTRIC: Electric fields Leveraged from multipole Expansion Calculations in Tinker Rapid Interface Codeacceptedv1.0.02020-07-02 19:00:20 UTC542020-10-27 16:27:51 UTC520202576JessicaNashThe Molecular Sciences Software Institute, 1880 Pratt Drive, Suite 1100, Blacksburg, VA 24060, Department of Chemistry, Davidson Hall, Virginia Tech, 1040 Drillfield Drive, Blacksburg, VA 240610000-0003-1967-5094TaylorBarnesThe Molecular Sciences Software Institute, 1880 Pratt Drive, Suite 1100, Blacksburg, VA 24060, Department of Chemistry, Davidson Hall, Virginia Tech, 1040 Drillfield Drive, Blacksburg, VA 240610000-0001-9396-1094ValerieVaissierWelbornDepartment of Chemistry, Davidson Hall, Virginia Tech, 1040 Drillfield Drive, Blacksburg, VA 240610000-0003-0834-444110.21105/joss.02576https://doi.org/10.5281/zenodo.4116258Python, C, Fortranhttps://joss.theoj.org/papers/10.21105/joss.02576.pdfTinker, molecular dynamics, polarizable force fields, electric fields