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Toward Compact Selected Configuration Interaction Wave Functions with Quantum Monte Carlo─A Case Study of C 2
by
Ludovicy, Jil
,
Dahl, Robin
,
Lüchow, Arne
Published in
Journal of chemical theory and computation
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Toward Compact Selected Configuration Interaction Wave Functions with Quantum Monte CarloA Case Study of C2
by
Ludovicy, Jil
,
Dahl, Robin
,
Lüchow, Arne
Published in
Journal of chemical theory and computation
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Determination of the semiexperimental equilibrium structure of 2-acetylthiophene in the presence of methyl internal rotation and substituent effects compared to thiophene
by
Dindi, Christina
,
Ludovicy, Jil
,
Terzi, Vladimir
,
Lüchow, Arne
,
Vogt, Natalja
,
Demaison, Jean
,
Nguyen, Ha Vinh Lam
Published in
Physical chemistry chemical physics : PCCP
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Full Wave Function Optimization with Quantum Monte CarloA Study of the Dissociation Energies of ZnO, FeO, FeH, and CrS
by
Ludovicy, Jil
,
Mood, Kaveh Haghighi
,
Lüchow, Arne
Published in
Journal of chemical theory and computation
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Ru on N‐doped Carbon for the Selective Hydrogenolysis of Sugars and Sugar Alcohols
by
Beine, Anna Katharina
,
Ludovicy, Jil
,
Chai, Jiachun
,
Hofmann, Jan P.
,
Glotzbach, Christoph
,
Hausoul, Peter J. C.
,
Palkovits, Regina
Published in
ChemCatChem
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Full Wave Function Optimization with Quantum Monte Carlo -- A study of the Dissociation Energies of ZnO, FeO, FeH, and CrS
by
Ludovicy, Jil
,
Kaveh Haghighi Mood
,
Lüchow, Arne
Published in
arXiv.org
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