{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,30]],"date-time":"2026-10-30T06:31:47Z","timestamp":1793341907401,"version":"4.5.0"},"reference-count":52,"publisher":"Wiley","issue":"28","license":[{"start":{"date-parts":[[2026,10,27]],"date-time":"2026-10-27T00:00:00Z","timestamp":1793059200000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"},{"start":{"date-parts":[[2026,10,27]],"date-time":"2026-10-27T00:00:00Z","timestamp":1793059200000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["J Comput Chem"],"published-print":{"date-parts":[[2026,10,30]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    We present\n                    <jats:sc>vibe\u2010qc<\/jats:sc>\n                    , a general\u2010purpose open\u2010source electronic\u2010structure code for molecules and solids, developed almost entirely with agentic AI under expert human direction. The code is released under the Mozilla Public License 2.0 (MPLv2). The implementation comprises a C++17 numerical core and Python calculation drivers. Molecular methods include Hartree\u2013Fock, Kohn\u2013Sham DFT, M\u00f8ller\u2013Plesset theory and double hybrids, coupled cluster, active\u2010space methods, and excited states. Dispersion corrections, continuum solvation, and effective core potentials are also available. Periodic calculations use Gaussian\u2010basis HF and DFT with Brillouin\u2010zone sampling. Molecular and periodic method coverage differs; the feature matrices specify analytic and numerical derivatives and distinguish validated and experimental implementations. The validation set is a key contribution of this work. It combines independent program comparisons, published benchmarks, and internal consistency tests. Molecular mean\u2010field energies agree at the nanohartree scale, and conventional CCSD(T) energies agree within  for the tested systems. Local\u2010correlation and periodic limitations are reported with the comparisons. Numerical results, calculation metadata, and analysis scripts are supplied as machine\u2010readable . The independently maintained\n                    <jats:sc>vibe\u2010view<\/jats:sc>\n                    viewer,\n                    <jats:sc>vibe\u2010queue<\/jats:sc>\n                    scheduler, and\n                    <jats:sc>qvf<\/jats:sc>\n                    toolkit support visualization and job management;\n                    <jats:sc>trexio<\/jats:sc>\n                    provides wavefunction interchange.\n                  <\/jats:p>","DOI":"10.1002\/jcc.70525","type":"journal-article","created":{"date-parts":[[2026,10,27]],"date-time":"2026-10-27T14:28:27Z","timestamp":1793111307000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["<scp>vibe\u2010qc<\/scp>\n                    : An Open\u2010Source, General\u2010Purpose Electronic\u2010Structure Code for Molecules and Solids Developed With Generative\n                    <scp>AI<\/scp>"],"prefix":"10.1002","volume":"47","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-9425-5981","authenticated-orcid":false,"given":"Michael F.","family":"Peintinger","sequence":"first","affiliation":[{"name":"Mulliken Center for Theoretical Chemistry University of Bonn  Bonn Germany"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2026,10,27]]},"reference":[{"key":"e_1_2_13_2_1","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1610"},{"key":"e_1_2_13_3_1","doi-asserted-by":"publisher","DOI":"10.1063\/5.0175165"},{"key":"e_1_2_13_4_1","unstructured":"M. F.Peintinger \u201cI Vibe\u2010Coded a Quantum Chemical Program in One Day \u201d(2026) https:\/\/peintinger.com\/2026\/04\/22\/i\u2010vibe\u2010coded\u2010a\u2010quantum\u2010chemical\u2010program\u2010in\u2010one\u2010day\/."},{"key":"e_1_2_13_5_1","unstructured":"M. F.Peintinger \u201cThe Giants Vibe\u2010QC Stands on: A Guided Tour of the Stack \u201d(2026) https:\/\/peintinger.com\/2026\/04\/23\/the\u2010giants\u2010vibe\u2010qc\u2010stands\u2010on\u2010a\u2010guided\u2010tour\u2010of\u2010the\u2010stack\/."},{"key":"e_1_2_13_6_1","unstructured":"M. F.Peintinger \u201cVibe\u2010QC Documentation as Educational Artefact \u201d(2026) https:\/\/peintinger.com\/2026\/04\/26\/vibe\u2010qc\u2010documentation\u2010as\u2010educational\u2010artefact\/."},{"key":"e_1_2_13_7_1","unstructured":"M. F.Peintinger \u201cUsing Claude to Drive Vibe\u2010QC \u201d(2026) https:\/\/vibe\u2010qc.com\/using_claude.html Part of the Vibe\u2010QC Documentation Release Branch."},{"key":"e_1_2_13_8_1","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.70019"},{"key":"e_1_2_13_9_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.9b00532"},{"key":"e_1_2_13_10_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.3c00182"},{"key":"e_1_2_13_11_1","doi-asserted-by":"publisher","DOI":"10.1063\/5.0006074"},{"key":"e_1_2_13_12_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.2c00958"},{"key":"e_1_2_13_13_1","doi-asserted-by":"publisher","DOI":"10.1088\/0953\u20108984\/22\/25\/253202"},{"key":"e_1_2_13_14_1","doi-asserted-by":"publisher","DOI":"10.1063\/5.0006002"},{"key":"e_1_2_13_15_1","doi-asserted-by":"publisher","DOI":"10.1063\/5.0004635"},{"key":"e_1_2_13_16_1","doi-asserted-by":"publisher","DOI":"10.1063\/5.0055522"},{"key":"e_1_2_13_17_1","volume-title":"Gaussian 16, Revision C.01","author":"Frisch M. 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