#quantumchemistry — Public Fediverse posts
Live and recent posts from across the Fediverse tagged #quantumchemistry, aggregated by home.social.
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EXXOGEN is a DeepTech biotechnology startup redefining molecular recognition through a novel, first-principles (ab initio) analytical framework for quantum-level interactions.
#QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation #EXXOGEN
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EXXOGEN is a DeepTech biotechnology startup redefining molecular recognition through a novel, first-principles (ab initio) analytical framework for quantum-level interactions.
#QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation #EXXOGEN
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EXXOGEN is a DeepTech biotechnology startup redefining molecular recognition through a novel, first-principles (ab initio) analytical framework for quantum-level interactions.
#QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation #EXXOGEN
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EXXOGEN is a DeepTech biotechnology startup redefining molecular recognition through a novel, first-principles (ab initio) analytical framework for quantum-level interactions.
#QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation #EXXOGEN
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EXXOGEN is a DeepTech biotechnology startup redefining molecular recognition through a novel, first-principles (ab initio) analytical framework for quantum-level interactions.
#QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation #EXXOGEN
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Researchers have discovered that clusters of three thorium atoms exhibit an unusual, field-induced non-linear magnetic response, behaving as aromatic "superatoms" only when exposed to an external magnetic field.
#InorganicChemistry #Radiochemistry #QuantumChemistry #sflorg
https://www.sflorg.com/2026/08/chm08162601.html -
Researchers have discovered that clusters of three thorium atoms exhibit an unusual, field-induced non-linear magnetic response, behaving as aromatic "superatoms" only when exposed to an external magnetic field.
#InorganicChemistry #Radiochemistry #QuantumChemistry #sflorg
https://www.sflorg.com/2026/08/chm08162601.html -
Researchers have discovered that clusters of three thorium atoms exhibit an unusual, field-induced non-linear magnetic response, behaving as aromatic "superatoms" only when exposed to an external magnetic field.
#InorganicChemistry #Radiochemistry #QuantumChemistry #sflorg
https://www.sflorg.com/2026/08/chm08162601.html -
Researchers have discovered that clusters of three thorium atoms exhibit an unusual, field-induced non-linear magnetic response, behaving as aromatic "superatoms" only when exposed to an external magnetic field.
#InorganicChemistry #Radiochemistry #QuantumChemistry #sflorg
https://www.sflorg.com/2026/08/chm08162601.html -
Researchers have discovered that clusters of three thorium atoms exhibit an unusual, field-induced non-linear magnetic response, behaving as aromatic "superatoms" only when exposed to an external magnetic field.
#InorganicChemistry #Radiochemistry #QuantumChemistry #sflorg
https://www.sflorg.com/2026/08/chm08162601.html -
A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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A new era in quantum physics and biological simulations?
#Exxogen #QuantumPhysics #DeepTech #Biophysics #QuantumChemistry #DrugDiscovery #TheoreticalPhysics #Innovation
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Spin audit of SQD/QSCI quantum-chemistry benchmarks on iron–sulfur clusters
https://zenodo.org/records/21359923
Comments: https://news.ycombinator.com/item?id=49203707
#HackerNews #quantumchemistry #ironclusters #SQD #QSCI #benchmarks #spinaudit
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Spin audit of SQD/QSCI quantum-chemistry benchmarks on iron–sulfur clusters
https://zenodo.org/records/21359923
Comments: https://news.ycombinator.com/item?id=49203707
#HackerNews #quantumchemistry #ironclusters #SQD #QSCI #benchmarks #spinaudit
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Spin audit of SQD/QSCI quantum-chemistry benchmarks on iron–sulfur clusters
https://zenodo.org/records/21359923
Comments: https://news.ycombinator.com/item?id=49203707
#HackerNews #quantumchemistry #ironclusters #SQD #QSCI #benchmarks #spinaudit
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Spin audit of SQD/QSCI quantum-chemistry benchmarks on iron–sulfur clusters
https://zenodo.org/records/21359923
Comments: https://news.ycombinator.com/item?id=49203707
#HackerNews #quantumchemistry #ironclusters #SQD #QSCI #benchmarks #spinaudit
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Spin audit of SQD/QSCI quantum-chemistry benchmarks on iron–sulfur clusters
https://zenodo.org/records/21359923
Comments: https://news.ycombinator.com/item?id=49203707
#HackerNews #quantumchemistry #ironclusters #SQD #QSCI #benchmarks #spinaudit
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🎉 We're excited to share that our latest paper, “Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study,” has been published in Pharmaceutical Research.
This work was carried out as part of Alexey Kovalev’s PhD research in collaboration with our colleagues Prof. Savaş Kaya (Sivas Cumhuriyet University, Türkiye) and Dr. Yoshio Barrera (UNAM, Mexico).
🔗 https://doi.org/10.1007/s11095-026-04162-9
#PharmaceuticalResearch #MedicinalChemistry #NMR #QuantumChemistry -
🎉 We're excited to share that our latest paper, “Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study,” has been published in Pharmaceutical Research.
This work was carried out as part of Alexey Kovalev’s PhD research in collaboration with our colleagues Prof. Savaş Kaya (Sivas Cumhuriyet University, Türkiye) and Dr. Yoshio Barrera (UNAM, Mexico).
🔗 https://doi.org/10.1007/s11095-026-04162-9
#PharmaceuticalResearch #MedicinalChemistry #NMR #QuantumChemistry -
🎉 We're excited to share that our latest paper, “Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study,” has been published in Pharmaceutical Research.
This work was carried out as part of Alexey Kovalev’s PhD research in collaboration with our colleagues Prof. Savaş Kaya (Sivas Cumhuriyet University, Türkiye) and Dr. Yoshio Barrera (UNAM, Mexico).
🔗 https://doi.org/10.1007/s11095-026-04162-9
#PharmaceuticalResearch #MedicinalChemistry #NMR #QuantumChemistry -
🎉 We're excited to share that our latest paper, “Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study,” has been published in Pharmaceutical Research.
This work was carried out as part of Alexey Kovalev’s PhD research in collaboration with our colleagues Prof. Savaş Kaya (Sivas Cumhuriyet University, Türkiye) and Dr. Yoshio Barrera (UNAM, Mexico).
🔗 https://doi.org/10.1007/s11095-026-04162-9
#PharmaceuticalResearch #MedicinalChemistry #NMR #QuantumChemistry -
🎉 We're excited to share that our latest paper, “Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study,” has been published in Pharmaceutical Research.
This work was carried out as part of Alexey Kovalev’s PhD research in collaboration with our colleagues Prof. Savaş Kaya (Sivas Cumhuriyet University, Türkiye) and Dr. Yoshio Barrera (UNAM, Mexico).
🔗 https://doi.org/10.1007/s11095-026-04162-9
#PharmaceuticalResearch #MedicinalChemistry #NMR #QuantumChemistry -
`Hirshfeld atom refinement (HAR) has begun to emerge as an alternative, potentially more accessible, quantum crystallography approach for experimentally visualizing covalency, but it has remained limited and technically impracticable regarding heavy element complexes... Here, we apply HAR to two extreme test cases of clusters containing three proximate heavy actinides exhibiting multi-center thorium-thorium bonding.`
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`Hirshfeld atom refinement (HAR) has begun to emerge as an alternative, potentially more accessible, quantum crystallography approach for experimentally visualizing covalency, but it has remained limited and technically impracticable regarding heavy element complexes... Here, we apply HAR to two extreme test cases of clusters containing three proximate heavy actinides exhibiting multi-center thorium-thorium bonding.`
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`Hirshfeld atom refinement (HAR) has begun to emerge as an alternative, potentially more accessible, quantum crystallography approach for experimentally visualizing covalency, but it has remained limited and technically impracticable regarding heavy element complexes... Here, we apply HAR to two extreme test cases of clusters containing three proximate heavy actinides exhibiting multi-center thorium-thorium bonding.`
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`Hirshfeld atom refinement (HAR) has begun to emerge as an alternative, potentially more accessible, quantum crystallography approach for experimentally visualizing covalency, but it has remained limited and technically impracticable regarding heavy element complexes... Here, we apply HAR to two extreme test cases of clusters containing three proximate heavy actinides exhibiting multi-center thorium-thorium bonding.`
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`Hirshfeld atom refinement (HAR) has begun to emerge as an alternative, potentially more accessible, quantum crystallography approach for experimentally visualizing covalency, but it has remained limited and technically impracticable regarding heavy element complexes... Here, we apply HAR to two extreme test cases of clusters containing three proximate heavy actinides exhibiting multi-center thorium-thorium bonding.`
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China's LineShine Supercomputer: A Sense of Scale ⚡🖥️
China's LineShine 灵晟 supercomputer is the most powerful supercomputer in the world 🌍, delivering a verified 2.198 exaFLOPS on the TOP500 benchmark. That means it can perform more than 2 quintillion (2×10¹⁸) calculations every second 🚀. The system consumes 42.2 megawatts of electricity ⚡ and is powered by more than 13.7 million conventional CPU cores 🧠.
The Scale of Its Computing Power 📊
Compared to Humanity 👥: If every person on Earth performed one mathematical calculation every second, without stopping ⏱️, it would take the entire global population about 4 years 📅 to equal the amount of computation LineShine completes in a single second.
Consumer Hardware 💻: Matching LineShine's sustained performance would require more than 20 million of today's fastest consumer graphics cards 🖥️, such as an RTX 5090, working together in perfect synchronization 🔗.
LineShine demonstrates the extraordinary scale of modern high-performance computing (HPC), enabling scientific calculations that would be practically impossible using conventional computers 🚀.
#Supercomputer #LineShine #Exascale #Exaflop #HPC #HighPerformanceComputing #Technology #Innovation #Science #Engineering #Computing #CPU #ParallelComputing #ClimateScience #WeatherForecasting #Neuroscience #QuantumChemistry #Physics #MolecularScience #DataScience #ArtificialIntelligence #AI #Research #STEM #FutureTech #DigitalEarth #ComputerScience #TechFacts #NextGenComputing #TOP500
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China's LineShine Supercomputer: A Sense of Scale ⚡🖥️
China's LineShine 灵晟 supercomputer is the most powerful supercomputer in the world 🌍, delivering a verified 2.198 exaFLOPS on the TOP500 benchmark. That means it can perform more than 2 quintillion (2×10¹⁸) calculations every second 🚀. The system consumes 42.2 megawatts of electricity ⚡ and is powered by more than 13.7 million conventional CPU cores 🧠.
The Scale of Its Computing Power 📊
Compared to Humanity 👥: If every person on Earth performed one mathematical calculation every second, without stopping ⏱️, it would take the entire global population about 4 years 📅 to equal the amount of computation LineShine completes in a single second.
Consumer Hardware 💻: Matching LineShine's sustained performance would require more than 20 million of today's fastest consumer graphics cards 🖥️, such as an RTX 5090, working together in perfect synchronization 🔗.
LineShine demonstrates the extraordinary scale of modern high-performance computing (HPC), enabling scientific calculations that would be practically impossible using conventional computers 🚀.
#Supercomputer #LineShine #Exascale #Exaflop #HPC #HighPerformanceComputing #Technology #Innovation #Science #Engineering #Computing #CPU #ParallelComputing #ClimateScience #WeatherForecasting #Neuroscience #QuantumChemistry #Physics #MolecularScience #DataScience #ArtificialIntelligence #AI #Research #STEM #FutureTech #DigitalEarth #ComputerScience #TechFacts #NextGenComputing #TOP500
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China's LineShine Supercomputer: A Sense of Scale ⚡🖥️
China's LineShine 灵晟 supercomputer is the most powerful supercomputer in the world 🌍, delivering a verified 2.198 exaFLOPS on the TOP500 benchmark. That means it can perform more than 2 quintillion (2×10¹⁸) calculations every second 🚀. The system consumes 42.2 megawatts of electricity ⚡ and is powered by more than 13.7 million conventional CPU cores 🧠.
The Scale of Its Computing Power 📊
Compared to Humanity 👥: If every person on Earth performed one mathematical calculation every second, without stopping ⏱️, it would take the entire global population about 4 years 📅 to equal the amount of computation LineShine completes in a single second.
Consumer Hardware 💻: Matching LineShine's sustained performance would require more than 20 million of today's fastest consumer graphics cards 🖥️, such as an RTX 5090, working together in perfect synchronization 🔗.
LineShine demonstrates the extraordinary scale of modern high-performance computing (HPC), enabling scientific calculations that would be practically impossible using conventional computers 🚀.
#Supercomputer #LineShine #Exascale #Exaflop #HPC #HighPerformanceComputing #Technology #Innovation #Science #Engineering #Computing #CPU #ParallelComputing #ClimateScience #WeatherForecasting #Neuroscience #QuantumChemistry #Physics #MolecularScience #DataScience #ArtificialIntelligence #AI #Research #STEM #FutureTech #DigitalEarth #ComputerScience #TechFacts #NextGenComputing #TOP500
-
China's LineShine Supercomputer: A Sense of Scale ⚡🖥️
China's LineShine 灵晟 supercomputer is the most powerful supercomputer in the world 🌍, delivering a verified 2.198 exaFLOPS on the TOP500 benchmark. That means it can perform more than 2 quintillion (2×10¹⁸) calculations every second 🚀. The system consumes 42.2 megawatts of electricity ⚡ and is powered by more than 13.7 million conventional CPU cores 🧠.
The Scale of Its Computing Power 📊
Compared to Humanity 👥: If every person on Earth performed one mathematical calculation every second, without stopping ⏱️, it would take the entire global population about 4 years 📅 to equal the amount of computation LineShine completes in a single second.
Consumer Hardware 💻: Matching LineShine's sustained performance would require more than 20 million of today's fastest consumer graphics cards 🖥️, such as an RTX 5090, working together in perfect synchronization 🔗.
LineShine demonstrates the extraordinary scale of modern high-performance computing (HPC), enabling scientific calculations that would be practically impossible using conventional computers 🚀.
#Supercomputer #LineShine #Exascale #Exaflop #HPC #HighPerformanceComputing #Technology #Innovation #Science #Engineering #Computing #CPU #ParallelComputing #ClimateScience #WeatherForecasting #Neuroscience #QuantumChemistry #Physics #MolecularScience #DataScience #ArtificialIntelligence #AI #Research #STEM #FutureTech #DigitalEarth #ComputerScience #TechFacts #NextGenComputing #TOP500
-
China's LineShine Supercomputer: A Sense of Scale ⚡🖥️
China's LineShine 灵晟 supercomputer is the most powerful supercomputer in the world 🌍, delivering a verified 2.198 exaFLOPS on the TOP500 benchmark. That means it can perform more than 2 quintillion (2×10¹⁸) calculations every second 🚀. The system consumes 42.2 megawatts of electricity ⚡ and is powered by more than 13.7 million conventional CPU cores 🧠.
The Scale of Its Computing Power 📊
Compared to Humanity 👥: If every person on Earth performed one mathematical calculation every second, without stopping ⏱️, it would take the entire global population about 4 years 📅 to equal the amount of computation LineShine completes in a single second.
Consumer Hardware 💻: Matching LineShine's sustained performance would require more than 20 million of today's fastest consumer graphics cards 🖥️, such as an RTX 5090, working together in perfect synchronization 🔗.
LineShine demonstrates the extraordinary scale of modern high-performance computing (HPC), enabling scientific calculations that would be practically impossible using conventional computers 🚀.
#Supercomputer #LineShine #Exascale #Exaflop #HPC #HighPerformanceComputing #Technology #Innovation #Science #Engineering #Computing #CPU #ParallelComputing #ClimateScience #WeatherForecasting #Neuroscience #QuantumChemistry #Physics #MolecularScience #DataScience #ArtificialIntelligence #AI #Research #STEM #FutureTech #DigitalEarth #ComputerScience #TechFacts #NextGenComputing #TOP500
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ERC Advanced Grants für Wissenschaftler der Universität Heidelberg – Förderungen des Europäischen Forschungsrates für Projekte an der Ruperto Carola und am Zentralinstitut für Seelische Gesundheit https://www.uni-heidelberg.de/de/newsroom/erc-advanced-grants-fuer-wissenschaftler-der-universitaet-heidelberg
_________ERC Advanced Grants for Researchers at Universität Heidelberg – Funding from the European Research Council for projects at Ruperto Carola and the Central Institute of Mental Health https://www.uni-heidelberg.de/en/newsroom/erc-advanced-grants-for-researchers-at-universitat-heidelberg
#universität #heidelberg #uniheidelberg #forschung #förderung #ERCAdG #quantumchemistry #ai #psychiatry #heat #aggression
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ERC Advanced Grants für Wissenschaftler der Universität Heidelberg – Förderungen des Europäischen Forschungsrates für Projekte an der Ruperto Carola und am Zentralinstitut für Seelische Gesundheit https://www.uni-heidelberg.de/de/newsroom/erc-advanced-grants-fuer-wissenschaftler-der-universitaet-heidelberg
_________ERC Advanced Grants for Researchers at Universität Heidelberg – Funding from the European Research Council for projects at Ruperto Carola and the Central Institute of Mental Health https://www.uni-heidelberg.de/en/newsroom/erc-advanced-grants-for-researchers-at-universitat-heidelberg
#universität #heidelberg #uniheidelberg #forschung #förderung #ERCAdG #quantumchemistry #ai #psychiatry #heat #aggression
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ERC Advanced Grants für Wissenschaftler der Universität Heidelberg – Förderungen des Europäischen Forschungsrates für Projekte an der Ruperto Carola und am Zentralinstitut für Seelische Gesundheit https://www.uni-heidelberg.de/de/newsroom/erc-advanced-grants-fuer-wissenschaftler-der-universitaet-heidelberg
_________ERC Advanced Grants for Researchers at Universität Heidelberg – Funding from the European Research Council for projects at Ruperto Carola and the Central Institute of Mental Health https://www.uni-heidelberg.de/en/newsroom/erc-advanced-grants-for-researchers-at-universitat-heidelberg
#universität #heidelberg #uniheidelberg #forschung #förderung #ERCAdG #quantumchemistry #ai #psychiatry #heat #aggression
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ERC Advanced Grants für Wissenschaftler der Universität Heidelberg – Förderungen des Europäischen Forschungsrates für Projekte an der Ruperto Carola und am Zentralinstitut für Seelische Gesundheit https://www.uni-heidelberg.de/de/newsroom/erc-advanced-grants-fuer-wissenschaftler-der-universitaet-heidelberg
_________ERC Advanced Grants for Researchers at Universität Heidelberg – Funding from the European Research Council for projects at Ruperto Carola and the Central Institute of Mental Health https://www.uni-heidelberg.de/en/newsroom/erc-advanced-grants-for-researchers-at-universitat-heidelberg
#universität #heidelberg #uniheidelberg #forschung #förderung #ERCAdG #quantumchemistry #ai #psychiatry #heat #aggression
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ERC Advanced Grants für Wissenschaftler der Universität Heidelberg – Förderungen des Europäischen Forschungsrates für Projekte an der Ruperto Carola und am Zentralinstitut für Seelische Gesundheit https://www.uni-heidelberg.de/de/newsroom/erc-advanced-grants-fuer-wissenschaftler-der-universitaet-heidelberg
_________ERC Advanced Grants for Researchers at Universität Heidelberg – Funding from the European Research Council for projects at Ruperto Carola and the Central Institute of Mental Health https://www.uni-heidelberg.de/en/newsroom/erc-advanced-grants-for-researchers-at-universitat-heidelberg
#universität #heidelberg #uniheidelberg #forschung #förderung #ERCAdG #quantumchemistry #ai #psychiatry #heat #aggression
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Ytterbium cesium fulleride (Yb₂CsC₆₀) is a newly synthesized, all-carbon molecular system that continuously conducts electrons and maintains a robust metallic state, even when subjected to extreme cryogenic temperatures.
#CondensedMatterPhysics #MaterialsScience #QuantumChemistry #sflorg
https://www.sflorg.com/2026/06/phy06142601.html -
Ytterbium cesium fulleride (Yb₂CsC₆₀) is a newly synthesized, all-carbon molecular system that continuously conducts electrons and maintains a robust metallic state, even when subjected to extreme cryogenic temperatures.
#CondensedMatterPhysics #MaterialsScience #QuantumChemistry #sflorg
https://www.sflorg.com/2026/06/phy06142601.html -
Ytterbium cesium fulleride (Yb₂CsC₆₀) is a newly synthesized, all-carbon molecular system that continuously conducts electrons and maintains a robust metallic state, even when subjected to extreme cryogenic temperatures.
#CondensedMatterPhysics #MaterialsScience #QuantumChemistry #sflorg
https://www.sflorg.com/2026/06/phy06142601.html -
Ytterbium cesium fulleride (Yb₂CsC₆₀) is a newly synthesized, all-carbon molecular system that continuously conducts electrons and maintains a robust metallic state, even when subjected to extreme cryogenic temperatures.
#CondensedMatterPhysics #MaterialsScience #QuantumChemistry #sflorg
https://www.sflorg.com/2026/06/phy06142601.html -
Ytterbium cesium fulleride (Yb₂CsC₆₀) is a newly synthesized, all-carbon molecular system that continuously conducts electrons and maintains a robust metallic state, even when subjected to extreme cryogenic temperatures.
#CondensedMatterPhysics #MaterialsScience #QuantumChemistry #sflorg
https://www.sflorg.com/2026/06/phy06142601.html -
🙂 Just released QuantumA Core,an open-source quantum circuit simulator with GPU acceleration and a REST API.
⚛️ Statevector / density-matrix / Monte Carlo
🎮 Up to 28 qubits on an 8 GB GPU (CUDA), automatic CPU fallback
🧪 Realistic T1/T2 noise models
🔬 Includes a validated H₂ VQE example (ground-state energy from first principles)MIT, Python.
👉 github.com/ShinRalexis/QuantumA-Core
#QuantumComputing #OpenSource #Python #CUDA #VQE #QuantumChemistry #PyTorch #FOSS
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🙂 Just released QuantumA Core,an open-source quantum circuit simulator with GPU acceleration and a REST API.
⚛️ Statevector / density-matrix / Monte Carlo
🎮 Up to 28 qubits on an 8 GB GPU (CUDA), automatic CPU fallback
🧪 Realistic T1/T2 noise models
🔬 Includes a validated H₂ VQE example (ground-state energy from first principles)MIT, Python.
👉 github.com/ShinRalexis/QuantumA-Core
#QuantumComputing #OpenSource #Python #CUDA #VQE #QuantumChemistry #PyTorch #FOSS
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🙂 Just released QuantumA Core,an open-source quantum circuit simulator with GPU acceleration and a REST API.
⚛️ Statevector / density-matrix / Monte Carlo
🎮 Up to 28 qubits on an 8 GB GPU (CUDA), automatic CPU fallback
🧪 Realistic T1/T2 noise models
🔬 Includes a validated H₂ VQE example (ground-state energy from first principles)MIT, Python.
👉 github.com/ShinRalexis/QuantumA-Core
#QuantumComputing #OpenSource #Python #CUDA #VQE #QuantumChemistry #PyTorch #FOSS
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🙂 Just released QuantumA Core,an open-source quantum circuit simulator with GPU acceleration and a REST API.
⚛️ Statevector / density-matrix / Monte Carlo
🎮 Up to 28 qubits on an 8 GB GPU (CUDA), automatic CPU fallback
🧪 Realistic T1/T2 noise models
🔬 Includes a validated H₂ VQE example (ground-state energy from first principles)MIT, Python.
👉 github.com/ShinRalexis/QuantumA-Core
#QuantumComputing #OpenSource #Python #CUDA #VQE #QuantumChemistry #PyTorch #FOSS
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🎉 I've been featured as one of 21 Early Career Investigators in the Journal of Natural Products 2026 Collection!
My work bridges quantum chemistry and pharmacognosy: asking computational questions about why natural products like hypericin behave the way they do as photosensitizers. Niche? Yes. Worth it? Absolutely.
📰 Editorial: https://doi.org/10.1021/acs.jnatprod.6c00551
#NaturalProducts #ComputationalChemistry #QuantumChemistry #Pharmacognosy #EarlyCareer #Habilitation#ACS #Hypericin #SciComm #Chemistry
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🎉 I've been featured as one of 21 Early Career Investigators in the Journal of Natural Products 2026 Collection!
My work bridges quantum chemistry and pharmacognosy: asking computational questions about why natural products like hypericin behave the way they do as photosensitizers. Niche? Yes. Worth it? Absolutely.
📰 Editorial: https://doi.org/10.1021/acs.jnatprod.6c00551
#NaturalProducts #ComputationalChemistry #QuantumChemistry #Pharmacognosy #EarlyCareer #Habilitation#ACS #Hypericin #SciComm #Chemistry
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🎉 I've been featured as one of 21 Early Career Investigators in the Journal of Natural Products 2026 Collection!
My work bridges quantum chemistry and pharmacognosy: asking computational questions about why natural products like hypericin behave the way they do as photosensitizers. Niche? Yes. Worth it? Absolutely.
📰 Editorial: https://doi.org/10.1021/acs.jnatprod.6c00551
#NaturalProducts #ComputationalChemistry #QuantumChemistry #Pharmacognosy #EarlyCareer #Habilitation#ACS #Hypericin #SciComm #Chemistry
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🎉 I've been featured as one of 21 Early Career Investigators in the Journal of Natural Products 2026 Collection!
My work bridges quantum chemistry and pharmacognosy: asking computational questions about why natural products like hypericin behave the way they do as photosensitizers. Niche? Yes. Worth it? Absolutely.
📰 Editorial: https://doi.org/10.1021/acs.jnatprod.6c00551
#NaturalProducts #ComputationalChemistry #QuantumChemistry #Pharmacognosy #EarlyCareer #Habilitation#ACS #Hypericin #SciComm #Chemistry
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🎉 I've been featured as one of 21 Early Career Investigators in the Journal of Natural Products 2026 Collection!
My work bridges quantum chemistry and pharmacognosy: asking computational questions about why natural products like hypericin behave the way they do as photosensitizers. Niche? Yes. Worth it? Absolutely.
📰 Editorial: https://doi.org/10.1021/acs.jnatprod.6c00551
#NaturalProducts #ComputationalChemistry #QuantumChemistry #Pharmacognosy #EarlyCareer #Habilitation#ACS #Hypericin #SciComm #Chemistry
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Technical Infrastructure: NVIDIA cuEST Integration
NVIDIA cuEST is a new GPU library for quantum chemistry. It helps speed up complex calculations for scientists. Learn how it works and who it helps.
#NVIDIA #cuEST #QuantumChemistry #GPU #HighPerformanceComputing
https://newsletter.tf/nvidia-cu-est-gpu-library-quantum-chemistry/